Benzamide, 3-cyano-


Chemical Name: Benzamide, 3-cyano-
CAS Number: 3441-01-8
Product Number: AG00BXOH(AGN-PC-0JLQE6)
Synonyms:
MDL No:
Molecular Formula: C8H6N2O
Molecular Weight: 146.1460

Identification/Properties


Computed Properties
Molecular Weight:
146.149g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
146.048g/mol
Monoisotopic Mass:
146.048g/mol
Topological Polar Surface Area:
66.9A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
203
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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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