N-Cyano-N'-(hydroxymethyl)guanidine

Base Information

• Chemical Name: N-Cyano-N'-(hydroxymethyl)guanidine
• CAS No.: 34378-54-6
• Deprecated CAS: 50865-08-2
• Molecular Formula: C3H6N4O
• Molecular Weight: 114.1059
• European Community (EC) Number: 236-019-8
• NSC Number: 643467
• DSSTox Substance ID: DTXSID0065351
• ChEMBL ID: CHEMBL1997758
• Mol file: 34378-54-6.mol

Synonyms:N-Cyano-N'-(hydroxymethyl)guanidine;NSC643467;Guanidine, N-cyano-N'-(hydroxymethyl)-;EINECS 236-019-8;13101-26-3;1-cyano-3-(hydroxymethyl)guanidine;C3H6N4O;Guanidine, cyano(hydroxymethyl)-;C3-H6-N4-O;Guanidine, 1-cyano-3-(hydroxymethyl)-;Methyloldicyandiamide;SCHEMBL1070780;CHEMBL1997758;DTXSID0065351;SCHEMBL10543213;SCHEMBL21625934;34378-54-6;Guanidine, N-cyano(hydroxymethyl)-;AKOS006348892;NSC-643467;NCI60_014704

Chemical Property of N-Cyano-N'-(hydroxymethyl)guanidine

Chemical Property:

• Vapor Pressure: 0.0151mmHg at 25°C
• Boiling Point: 240.9°Cat760mmHg
• Flash Point: 99.5°C
• PSA: 0.00000
• Density: 1.41g/cm³
• LogP: 0.00000
• XLogP3: -1.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 114.05416083
• Heavy Atom Count: 8
• Complexity: 132

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C(N=C(N)NC#N)O
• Isomeric SMILES: C(/N=C(\N)/NC#N)O