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Isotopically Labeled Compounds

Isotopically Labeled Compounds

Chemicals to which isotopes have been attached in order to label specific atoms. Isotopically labeled compounds are commonly used in synthetic chemistry, characterization techniques such as NMR, and biology.
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1 – 15 of 221 results
1

Tetrahydrofuran-D8, for NMR, 99.5 atom % D, Thermo Scientific Chemicals

CAS: 1693-74-9 Molecular Formula: C4H8O Molecular Weight (g/mol): 80.16 MDL Number: MFCD00044238 InChI Key: WYURNTSHIVDZCO-SVYQBANQSA-N Synonym: tetrahydrofuran-d8,deuterated thf,octadeuterotetrahydrofuran,deuterated tetrahydrofuran,tetrahydrofuran-d8 thf-d8,tetrahydrofuran-d8, ≥99.5 atom % d,2h4 tetrahydro 2h4 furan,thf-d8,2h8 tetrahydrofuran,furan-d4-, tetrahydro-d4 PubChem CID: 80290 SMILES: [2H]C1([2H])OC([2H])([2H])C([2H])([2H])C1([2H])[2H]

PubChem CID 80290
CAS 1693-74-9
Molecular Weight (g/mol) 80.16
MDL Number MFCD00044238
SMILES [2H]C1([2H])OC([2H])([2H])C([2H])([2H])C1([2H])[2H]
Synonym tetrahydrofuran-d8,deuterated thf,octadeuterotetrahydrofuran,deuterated tetrahydrofuran,tetrahydrofuran-d8 thf-d8,tetrahydrofuran-d8, ≥99.5 atom % d,2h4 tetrahydro 2h4 furan,thf-d8,2h8 tetrahydrofuran,furan-d4-, tetrahydro-d4
InChI Key WYURNTSHIVDZCO-SVYQBANQSA-N
Molecular Formula C4H8O
2

N,N-Dimethylformamide-d{7}, 99.5% (Isotopic), Thermo Scientific Chemicals

CAS: 4472-41-7 Molecular Formula: C3H7NO Molecular Weight (g/mol): 80.138 MDL Number: MFCD00003286 InChI Key: ZMXDDKWLCZADIW-YYWVXINBSA-N Synonym: n,n-dimethylformamide-d7,dmf-d7,deuterated dmf,n,n-di 2h3 methyl 2h formamide,dimethyl formamide-d7,dimethylformamide d,heptadeutero-n,n-dimethylformamide,n,n-dimethylformamide-d7 dmf-d7,formamide-1-d, n,n-di methyl-d3,n,n-dimethylformamide-d7 99.5atom%d PubChem CID: 78225 IUPAC Name: 1-deuterio-N,N-bis(trideuteriomethyl)formamide SMILES: CN(C)C=O

PubChem CID 78225
CAS 4472-41-7
Molecular Weight (g/mol) 80.138
MDL Number MFCD00003286
SMILES CN(C)C=O
Synonym n,n-dimethylformamide-d7,dmf-d7,deuterated dmf,n,n-di 2h3 methyl 2h formamide,dimethyl formamide-d7,dimethylformamide d,heptadeutero-n,n-dimethylformamide,n,n-dimethylformamide-d7 dmf-d7,formamide-1-d, n,n-di methyl-d3,n,n-dimethylformamide-d7 99.5atom%d
IUPAC Name 1-deuterio-N,N-bis(trideuteriomethyl)formamide
InChI Key ZMXDDKWLCZADIW-YYWVXINBSA-N
Molecular Formula C3H7NO
3

Chloroform-d, for NMR, 99.8% atom D, Thermo Scientific Chemicals

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

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PubChem CID 71583
CAS 865-49-6
Molecular Weight (g/mol) 120.375
ChEBI CHEBI:85365
MDL Number MFCD00000827
SMILES C(Cl)(Cl)Cl
Synonym chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero
IUPAC Name trichloro(deuterio)methane
InChI Key HEDRZPFGACZZDS-MICDWDOJSA-N
Molecular Formula CHCl3
4

Methyl sulfoxide-d6, for NMR, 99.5+% atom D, Thermo Scientific Chemicals

CAS: 2206-27-1 Molecular Formula: C2H6OS Molecular Weight (g/mol): 84.17 MDL Number: MFCD00002090 InChI Key: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: dimethyl sulfoxide-d6,dmso-d6,dimethylsulfoxide-d6,deuterated dmso,methane-d3,sulfinylbis-9ci,methane-d3, sulfinylbis,hexadeuterodimethyl sulfoxide,methane-d3-, sulfinylbis,methanesulfinylmethyl hydrogen,dimethyl-d6 sulfoxide PubChem CID: 75151 SMILES: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

PubChem CID 75151
CAS 2206-27-1
Molecular Weight (g/mol) 84.17
MDL Number MFCD00002090
SMILES [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]
Synonym dimethyl sulfoxide-d6,dmso-d6,dimethylsulfoxide-d6,deuterated dmso,methane-d3,sulfinylbis-9ci,methane-d3, sulfinylbis,hexadeuterodimethyl sulfoxide,methane-d3-, sulfinylbis,methanesulfinylmethyl hydrogen,dimethyl-d6 sulfoxide
InChI Key IAZDPXIOMUYVGZ-WFGJKAKNSA-N
Molecular Formula C2H6OS
5

Dimethyl sulfoxide-d{6}, 99.5% (Isotopic), Thermo Scientific Chemicals

CAS: 2206-27-1 Molecular Formula: C2H6OS Molecular Weight (g/mol): 84.17 MDL Number: MFCD00002090 InChI Key: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: dimethyl sulfoxide-d6,dmso-d6,dimethylsulfoxide-d6,deuterated dmso,methane-d3,sulfinylbis-9ci,methane-d3, sulfinylbis,hexadeuterodimethyl sulfoxide,methane-d3-, sulfinylbis,methanesulfinylmethyl hydrogen,dimethyl-d6 sulfoxide PubChem CID: 75151 IUPAC Name: trideuterio(trideuteriomethylsulfinyl)methane SMILES: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

PubChem CID 75151
CAS 2206-27-1
Molecular Weight (g/mol) 84.17
MDL Number MFCD00002090
SMILES [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]
Synonym dimethyl sulfoxide-d6,dmso-d6,dimethylsulfoxide-d6,deuterated dmso,methane-d3,sulfinylbis-9ci,methane-d3, sulfinylbis,hexadeuterodimethyl sulfoxide,methane-d3-, sulfinylbis,methanesulfinylmethyl hydrogen,dimethyl-d6 sulfoxide
IUPAC Name trideuterio(trideuteriomethylsulfinyl)methane
InChI Key IAZDPXIOMUYVGZ-WFGJKAKNSA-N
Molecular Formula C2H6OS
6

Chloroform-d, for NMR, 99.8% atom D, stabilized with silver foil, Thermo Scientific Chemicals

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

PubChem CID 71583
CAS 865-49-6
Molecular Weight (g/mol) 120.375
ChEBI CHEBI:85365
MDL Number MFCD00000827
SMILES C(Cl)(Cl)Cl
Synonym chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero
IUPAC Name trichloro(deuterio)methane
InChI Key HEDRZPFGACZZDS-MICDWDOJSA-N
Molecular Formula CHCl3
7

Methyl sulfoxide-d6, for NMR, 99.8 atom % D, Thermo Scientific Chemicals

CAS: 2206-27-1 Molecular Formula: C2H6OS Molecular Weight (g/mol): 84.17 MDL Number: MFCD00002090 InChI Key: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: dimethyl sulfoxide-d6,dmso-d6,dimethylsulfoxide-d6,deuterated dmso,methane-d3,sulfinylbis-9ci,methane-d3, sulfinylbis,hexadeuterodimethyl sulfoxide,methane-d3-, sulfinylbis,methanesulfinylmethyl hydrogen,dimethyl-d6 sulfoxide PubChem CID: 75151 SMILES: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

PubChem CID 75151
CAS 2206-27-1
Molecular Weight (g/mol) 84.17
MDL Number MFCD00002090
SMILES [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]
Synonym dimethyl sulfoxide-d6,dmso-d6,dimethylsulfoxide-d6,deuterated dmso,methane-d3,sulfinylbis-9ci,methane-d3, sulfinylbis,hexadeuterodimethyl sulfoxide,methane-d3-, sulfinylbis,methanesulfinylmethyl hydrogen,dimethyl-d6 sulfoxide
InChI Key IAZDPXIOMUYVGZ-WFGJKAKNSA-N
Molecular Formula C2H6OS
8

Chloroform-d, for NMR, 99.6+% atom D, Thermo Scientific Chemicals

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

PubChem CID 71583
CAS 865-49-6
Molecular Weight (g/mol) 120.375
ChEBI CHEBI:85365
MDL Number MFCD00000827
SMILES C(Cl)(Cl)Cl
Synonym chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero
IUPAC Name trichloro(deuterio)methane
InChI Key HEDRZPFGACZZDS-MICDWDOJSA-N
Molecular Formula CHCl3
9

Dichloromethane-d2, for NMR, 99.8 atom% D, Thermo Scientific Chemicals

CAS: 1665-00-5 Molecular Formula: CH2Cl2 Molecular Weight (g/mol): 86.939 MDL Number: MFCD00000882 InChI Key: YMWUJEATGCHHMB-DICFDUPASA-N Synonym: dichloromethane-d2,methylene chloride-d2,dichloro 2h2 methane,methane-d2, dichloro,cd2cl2,deuterated dichloromethane,dichloro dideuterio methane,dideuteromethylene chloride,dichloromethane-d2, 99.9 atom % d,dichloromethane-d', 99.96 atom % d PubChem CID: 160586 IUPAC Name: dichloro(dideuterio)methane SMILES: C(Cl)Cl

PubChem CID 160586
CAS 1665-00-5
Molecular Weight (g/mol) 86.939
MDL Number MFCD00000882
SMILES C(Cl)Cl
Synonym dichloromethane-d2,methylene chloride-d2,dichloro 2h2 methane,methane-d2, dichloro,cd2cl2,deuterated dichloromethane,dichloro dideuterio methane,dideuteromethylene chloride,dichloromethane-d2, 99.9 atom % d,dichloromethane-d', 99.96 atom % d
IUPAC Name dichloro(dideuterio)methane
InChI Key YMWUJEATGCHHMB-DICFDUPASA-N
Molecular Formula CH2Cl2
10

Dichloromethane-d2, for NMR, 99.5 atom % D, Thermo Scientific Chemicals

CAS: 1665-00-5 Molecular Formula: CH2Cl2 MDL Number: MFCD00000882 InChI Key: YMWUJEATGCHHMB-DICFDUPASA-N Synonym: dichloromethane-d2, 99.9 atom % d,dichloro dideuterio methane,cd2cl2,dichloromethane-d', 99.96 atom % d,dichloro 2h2 methane,dideuteromethylene chloride,methylene chloride-d2,methane-d2, dichloro,dichloromethane-d2,deuterated dichloromethane PubChem CID: 160586

PubChem CID 160586
CAS 1665-00-5
MDL Number MFCD00000882
Synonym dichloromethane-d2, 99.9 atom % d,dichloro dideuterio methane,cd2cl2,dichloromethane-d', 99.96 atom % d,dichloro 2h2 methane,dideuteromethylene chloride,methylene chloride-d2,methane-d2, dichloro,dichloromethane-d2,deuterated dichloromethane
InChI Key YMWUJEATGCHHMB-DICFDUPASA-N
Molecular Formula CH2Cl2
12

Dichloromethane-d2, for NMR, packaged in 1.00 ml ampoules, 99.6+ atom % D, Thermo Scientific Chemicals

CAS: 1665-00-5 Molecular Formula: CH2Cl2 Molecular Weight (g/mol): 86.939 MDL Number: MFCD00000882 InChI Key: YMWUJEATGCHHMB-DICFDUPASA-N Synonym: dichloromethane-d2,methylene chloride-d2,dichloro 2h2 methane,methane-d2, dichloro,cd2cl2,deuterated dichloromethane,dichloro dideuterio methane,dideuteromethylene chloride,dichloromethane-d2, 99.9 atom % d,dichloromethane-d', 99.96 atom % d PubChem CID: 160586 IUPAC Name: dichloro(dideuterio)methane SMILES: C(Cl)Cl

PubChem CID 160586
CAS 1665-00-5
Molecular Weight (g/mol) 86.939
MDL Number MFCD00000882
SMILES C(Cl)Cl
Synonym dichloromethane-d2,methylene chloride-d2,dichloro 2h2 methane,methane-d2, dichloro,cd2cl2,deuterated dichloromethane,dichloro dideuterio methane,dideuteromethylene chloride,dichloromethane-d2, 99.9 atom % d,dichloromethane-d', 99.96 atom % d
IUPAC Name dichloro(dideuterio)methane
InChI Key YMWUJEATGCHHMB-DICFDUPASA-N
Molecular Formula CH2Cl2
14

Acetone-d6, for NMR, contains 1 v/v% TMS, 99.5% atom D, Thermo Scientific Chemicals

CAS: 666-52-4 Molecular Formula: C3H6O Molecular Weight (g/mol): 64.117 MDL Number: MFCD00044635 InChI Key: CSCPPACGZOOCGX-WFGJKAKNSA-N Synonym: acetone-d6,2h6 acetone,hexadeuteroacetone,acetone d6,perdeuteroacetone,deuterated acetone,unii-b0n19b53h8,cd3 2co,2-propanone-1,1,1,3,3,3-d6,d6-acetone PubChem CID: 522220 ChEBI: CHEBI:78217 IUPAC Name: 1,1,1,3,3,3-hexadeuteriopropan-2-one SMILES: CC(=O)C

PubChem CID 522220
CAS 666-52-4
Molecular Weight (g/mol) 64.117
ChEBI CHEBI:78217
MDL Number MFCD00044635
SMILES CC(=O)C
Synonym acetone-d6,2h6 acetone,hexadeuteroacetone,acetone d6,perdeuteroacetone,deuterated acetone,unii-b0n19b53h8,cd3 2co,2-propanone-1,1,1,3,3,3-d6,d6-acetone
IUPAC Name 1,1,1,3,3,3-hexadeuteriopropan-2-one
InChI Key CSCPPACGZOOCGX-WFGJKAKNSA-N
Molecular Formula C3H6O
15

Nitrobenzene-d5, for NMR, 99% atom D, Thermo Scientific Chemicals

CAS: 4165-60-0 Molecular Formula: C6H5NO2 Molecular Weight (g/mol): 128.14 MDL Number: MFCD00044415 InChI Key: LQNUZADURLCDLV-RALIUCGRSA-N Synonym: nitrobenzene-d5,benzene-d5, nitro,nitrobenzene d5,benzene-d5-, nitro,1-nitro 2 h? benzene,nitrobenzene-d5, 99.5 atom % d,nitro 2h5 benzene,1-nitro 2h5 benzene,2h5 benzene, nitro,nitrobenzene-d5, analytical standard PubChem CID: 123210 IUPAC Name: 1,2,3,4,5-pentadeuterio-6-nitrobenzene SMILES: [2H]C1=C([2H])C([2H])=C(C([2H])=C1[2H])[N+]([O-])=O

PubChem CID 123210
CAS 4165-60-0
Molecular Weight (g/mol) 128.14
MDL Number MFCD00044415
SMILES [2H]C1=C([2H])C([2H])=C(C([2H])=C1[2H])[N+]([O-])=O
Synonym nitrobenzene-d5,benzene-d5, nitro,nitrobenzene d5,benzene-d5-, nitro,1-nitro 2 h? benzene,nitrobenzene-d5, 99.5 atom % d,nitro 2h5 benzene,1-nitro 2h5 benzene,2h5 benzene, nitro,nitrobenzene-d5, analytical standard
IUPAC Name 1,2,3,4,5-pentadeuterio-6-nitrobenzene
InChI Key LQNUZADURLCDLV-RALIUCGRSA-N
Molecular Formula C6H5NO2