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Organic cyanides

Organic cyanides

Organic compounds that contain a carbon atom bonded to a nitrogen atom via a triple bond in the following structure: R-C≡N, where R is any carbon chain or group. Organic cyanides are also known as nitriles, and are less toxic than cyanide salts.
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1 – 11 of 11 results
1

Cyanogen bromide, Thermo Scientific Chemicals

CAS: 506-68-3 Molecular Formula: CBrN Molecular Weight (g/mol): 105.922 MDL Number: MFCD00011597 InChI Key: ATDGTVJJHBUTRL-UHFFFAOYSA-N Synonym: cyanogen bromide,bromine cyanide,bromocyanide,cyanobromide,bromocyanogen,bromocyan,campilit,cyanogen monobromide,bromure de cyanogen,cyanogen bromide brcn PubChem CID: 10476 IUPAC Name: carbononitridic bromide SMILES: C(#N)Br

PubChem CID 10476
CAS 506-68-3
Molecular Weight (g/mol) 105.922
MDL Number MFCD00011597
SMILES C(#N)Br
Synonym cyanogen bromide,bromine cyanide,bromocyanide,cyanobromide,bromocyanogen,bromocyan,campilit,cyanogen monobromide,bromure de cyanogen,cyanogen bromide brcn
IUPAC Name carbononitridic bromide
InChI Key ATDGTVJJHBUTRL-UHFFFAOYSA-N
Molecular Formula CBrN
2

Cyanogen bromide, 97%, Thermo Scientific Chemicals

CAS: 506-68-3 Molecular Formula: CBrN MDL Number: MFCD00011597 InChI Key: ATDGTVJJHBUTRL-UHFFFAOYSA-N Synonym: cyanogen bromide,bromine cyanide,bromocyanide,cyanobromide,bromocyanogen,bromocyan,campilit,cyanogen monobromide,bromure de cyanogen,cyanogen bromide brcn PubChem CID: 10476 IUPAC Name: carbononitridic bromide SMILES: C(#N)Br

PubChem CID 10476
CAS 506-68-3
MDL Number MFCD00011597
SMILES C(#N)Br
Synonym cyanogen bromide,bromine cyanide,bromocyanide,cyanobromide,bromocyanogen,bromocyan,campilit,cyanogen monobromide,bromure de cyanogen,cyanogen bromide brcn
IUPAC Name carbononitridic bromide
InChI Key ATDGTVJJHBUTRL-UHFFFAOYSA-N
Molecular Formula CBrN
4

Iminodiacetonitrile, 95%, Thermo Scientific Chemicals

CAS: 628-87-5 Molecular Formula: C4H5N3 Molecular Weight (g/mol): 95.11 MDL Number: MFCD00001887 InChI Key: BSRDNMMLQYNQQD-UHFFFAOYSA-N Synonym: iminodiacetonitrile,2,2'-azanediyldiacetonitrile,acetonitrile, 2,2'-iminobis,1,1'-imidodiacetonitrile,acetonitrile, iminodi,2,2'-iminodiacetonitrile,2,2'-iminobisacetonitrile,bis cyanomethyl amine,di cianometil ammina,2-cyanomethyl amino acetonitrile PubChem CID: 69413 ChEBI: CHEBI:71189 IUPAC Name: 2-(cyanomethylamino)acetonitrile SMILES: N#CCNCC#N

PubChem CID 69413
CAS 628-87-5
Molecular Weight (g/mol) 95.11
ChEBI CHEBI:71189
MDL Number MFCD00001887
SMILES N#CCNCC#N
Synonym iminodiacetonitrile,2,2'-azanediyldiacetonitrile,acetonitrile, 2,2'-iminobis,1,1'-imidodiacetonitrile,acetonitrile, iminodi,2,2'-iminodiacetonitrile,2,2'-iminobisacetonitrile,bis cyanomethyl amine,di cianometil ammina,2-cyanomethyl amino acetonitrile
IUPAC Name 2-(cyanomethylamino)acetonitrile
InChI Key BSRDNMMLQYNQQD-UHFFFAOYSA-N
Molecular Formula C4H5N3
5

Pyruvonitrile, tech. 90%, Thermo Scientific Chemicals

CAS: 631-57-2 Molecular Formula: C3H3NO Molecular Weight (g/mol): 69.063 MDL Number: MFCD00001838 InChI Key: QLDHWVVRQCGZLE-UHFFFAOYSA-N Synonym: pyruvonitrile,propanenitrile, 2-oxo,oxopropionitrile,2-oxopropiononitrile,2-oxopropionitrile,oxypropionitrile,pyruvic acid nitrile,unii-ulo441649v,accn,.alpha.-oxopropionitrile PubChem CID: 69430 IUPAC Name: acetyl cyanide SMILES: CC(=O)C#N

PubChem CID 69430
CAS 631-57-2
Molecular Weight (g/mol) 69.063
MDL Number MFCD00001838
SMILES CC(=O)C#N
Synonym pyruvonitrile,propanenitrile, 2-oxo,oxopropionitrile,2-oxopropiononitrile,2-oxopropionitrile,oxypropionitrile,pyruvic acid nitrile,unii-ulo441649v,accn,.alpha.-oxopropionitrile
IUPAC Name acetyl cyanide
InChI Key QLDHWVVRQCGZLE-UHFFFAOYSA-N
Molecular Formula C3H3NO
6

Cyanogen iodide, 98%, Thermo Scientific Chemicals

CAS: 506-78-5 Molecular Formula: CIN InChI Key: WPBXOELOQKLBDF-UHFFFAOYSA-N Synonym: cyanogen iodide,iodine cyanide,jodcyan,iodocyanide,iodine monocyanide,cyanogen monoiodide,iodine cyanide i cn,unii-81esv254uf,cyanic iodide,cyano iodide PubChem CID: 10478 IUPAC Name: carbononitridic iodide SMILES: C(#N)I

PubChem CID 10478
CAS 506-78-5
SMILES C(#N)I
Synonym cyanogen iodide,iodine cyanide,jodcyan,iodocyanide,iodine monocyanide,cyanogen monoiodide,iodine cyanide i cn,unii-81esv254uf,cyanic iodide,cyano iodide
IUPAC Name carbononitridic iodide
InChI Key WPBXOELOQKLBDF-UHFFFAOYSA-N
Molecular Formula CIN
7

Methylaminoacetonitrile hydrochloride, 99%, Thermo Scientific Chemicals

CAS: 25808-30-4 Molecular Formula: C3H7ClN2 Molecular Weight (g/mol): 106.553 MDL Number: MFCD00012587 InChI Key: DFKBQHBEROHUNF-UHFFFAOYSA-N Synonym: methylaminoacetonitrile hydrochloride,2-methylamino acetonitrile hydrochloride,acetonitrile, methylamino-, monohydrochloride,sarcosinenitrile hydrochloride,n-methylaminoacetonitrile hydrochloride,acetonitrile, 2-methylamino-, hydrochloride 1:1,methylamino acetonitrilhydrochlorid,methylaminoacetonitrile, hydrochloride,methylaminoacetonitrilehydrochloride,cyanomethyl methyl ammonium chloride PubChem CID: 117641 IUPAC Name: 2-(methylamino)acetonitrile;hydrochloride SMILES: CNCC#N.Cl

PubChem CID 117641
CAS 25808-30-4
Molecular Weight (g/mol) 106.553
MDL Number MFCD00012587
SMILES CNCC#N.Cl
Synonym methylaminoacetonitrile hydrochloride,2-methylamino acetonitrile hydrochloride,acetonitrile, methylamino-, monohydrochloride,sarcosinenitrile hydrochloride,n-methylaminoacetonitrile hydrochloride,acetonitrile, 2-methylamino-, hydrochloride 1:1,methylamino acetonitrilhydrochlorid,methylaminoacetonitrile, hydrochloride,methylaminoacetonitrilehydrochloride,cyanomethyl methyl ammonium chloride
IUPAC Name 2-(methylamino)acetonitrile;hydrochloride
InChI Key DFKBQHBEROHUNF-UHFFFAOYSA-N
Molecular Formula C3H7ClN2
8

1-Amino-1-cyclopropanecarbonitrile hydrochloride, 97%, Thermo Scientific Chemicals

CAS: 127946-77-4 Molecular Formula: C4H7ClN2 Molecular Weight (g/mol): 118.564 MDL Number: MFCD04114063 InChI Key: PCEIEQLJYDMRFZ-UHFFFAOYSA-N Synonym: 1-amino-1-cyclopropanecarbonitrile hydrochloride,1-aminocyclopropanecarbonitrile hydrochloride,1-aminocyclopropane-1-carbonitrile hydrochloride,1-aminocyclopropanecarbonitrile hcl,1-amino-cyclopropyl cyanic hydrochloride,1-amino-1-cyanocyclopropane hydrochloride,1-amino-cyclopropanecarbonitrile hydrochloride,cyclopropanecarbonitrile, 1-amino-, monohydrochloride,1-cyanocyclopropanaminium chloride,pubchem16832 PubChem CID: 14586363 IUPAC Name: 1-aminocyclopropane-1-carbonitrile;hydrochloride SMILES: C1CC1(C#N)N.Cl

PubChem CID 14586363
CAS 127946-77-4
Molecular Weight (g/mol) 118.564
MDL Number MFCD04114063
SMILES C1CC1(C#N)N.Cl
Synonym 1-amino-1-cyclopropanecarbonitrile hydrochloride,1-aminocyclopropanecarbonitrile hydrochloride,1-aminocyclopropane-1-carbonitrile hydrochloride,1-aminocyclopropanecarbonitrile hcl,1-amino-cyclopropyl cyanic hydrochloride,1-amino-1-cyanocyclopropane hydrochloride,1-amino-cyclopropanecarbonitrile hydrochloride,cyclopropanecarbonitrile, 1-amino-, monohydrochloride,1-cyanocyclopropanaminium chloride,pubchem16832
IUPAC Name 1-aminocyclopropane-1-carbonitrile;hydrochloride
InChI Key PCEIEQLJYDMRFZ-UHFFFAOYSA-N
Molecular Formula C4H7ClN2
9

1-Cyanomethylpiperidine, 98%, Thermo Scientific™

CAS: 3010-03-5 MDL Number: MFCD00023733

CAS 3010-03-5
MDL Number MFCD00023733
10

4-Methyl-1-piperazineacetonitrile, 97%, Thermo Scientific™

CAS: 874-77-1 Molecular Formula: C7H13N3 Molecular Weight (g/mol): 139.202 InChI Key: XCUQQNRWWCWVOP-UHFFFAOYSA-N Synonym: 2-4-methylpiperazin-1-yl acetonitrile,4-methylpiperazin-1-yl acetonitrile,4-methyl-1-piperazineacetonitrile,1-4-methylpiperazine acetonitrile,1-cyanomethyl-4-methylpiperazine,1-piperazineacetonitrile, 4-methyl,4-methyl-piperazin-yl-acetonitrile,4-methyl-piperazin-1-yl-acetonitrile PubChem CID: 10582860 IUPAC Name: 2-(4-methylpiperazin-1-yl)acetonitrile SMILES: CN1CCN(CC1)CC#N

PubChem CID 10582860
CAS 874-77-1
Molecular Weight (g/mol) 139.202
SMILES CN1CCN(CC1)CC#N
Synonym 2-4-methylpiperazin-1-yl acetonitrile,4-methylpiperazin-1-yl acetonitrile,4-methyl-1-piperazineacetonitrile,1-4-methylpiperazine acetonitrile,1-cyanomethyl-4-methylpiperazine,1-piperazineacetonitrile, 4-methyl,4-methyl-piperazin-yl-acetonitrile,4-methyl-piperazin-1-yl-acetonitrile
IUPAC Name 2-(4-methylpiperazin-1-yl)acetonitrile
InChI Key XCUQQNRWWCWVOP-UHFFFAOYSA-N
Molecular Formula C7H13N3
11

Aminomalononitrile p-toluenesulfonate, 97+%, Thermo Scientific Chemicals

CAS: 5098-14-6 Molecular Formula: C10H11N3O3S Molecular Weight (g/mol): 253.276 MDL Number: MFCD00012848 InChI Key: MEUWQVWJLLBVQI-UHFFFAOYSA-N Synonym: aminomalononitrile p-toluenesulfonate,2-aminomalononitrile 4-methylbenzenesulfonate,aminomalononitrile p-toluenesulphonate,aminomalononitrile p-toluenesulfonic acid,aminomalononitrile tosylate,aminomalononitrile-p-toluene sulfonate,2-aminomalononitrile 4-methylbenzenesulphonate,2-aminomalononitrile p-toluenesulfonate,acmc-209krb,dicyanomethanaminium 4-methylbenzenesulfonate PubChem CID: 563049 IUPAC Name: 2-aminopropanedinitrile;4-methylbenzenesulfonic acid SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C(#N)C(C#N)N

PubChem CID 563049
CAS 5098-14-6
Molecular Weight (g/mol) 253.276
MDL Number MFCD00012848
SMILES CC1=CC=C(C=C1)S(=O)(=O)O.C(#N)C(C#N)N
Synonym aminomalononitrile p-toluenesulfonate,2-aminomalononitrile 4-methylbenzenesulfonate,aminomalononitrile p-toluenesulphonate,aminomalononitrile p-toluenesulfonic acid,aminomalononitrile tosylate,aminomalononitrile-p-toluene sulfonate,2-aminomalononitrile 4-methylbenzenesulphonate,2-aminomalononitrile p-toluenesulfonate,acmc-209krb,dicyanomethanaminium 4-methylbenzenesulfonate
IUPAC Name 2-aminopropanedinitrile;4-methylbenzenesulfonic acid
InChI Key MEUWQVWJLLBVQI-UHFFFAOYSA-N
Molecular Formula C10H11N3O3S