Carbamimidothioic acid, N-cyano-N'-phenyl-, methyl ester


Chemical Name: Carbamimidothioic acid, N-cyano-N'-phenyl-, methyl ester
CAS Number: 21504-96-1
Product Number: AG00C41S(AGN-PC-0KKM5T)
Synonyms:
MDL No:
Molecular Formula: C9H9N3S
Molecular Weight: 191.2529

Identification/Properties


Computed Properties
Molecular Weight:
191.252g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
191.052g/mol
Monoisotopic Mass:
191.052g/mol
Topological Polar Surface Area:
73.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
222
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback