Home Aminos 2-amino-N-(cyanomethyl)benzamide

2-amino-N-(cyanomethyl)benzamide

CAS No.:
234444-48-5
Catalog Number:
AG01AGUQ
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
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Product Description
Catalog Number:
AG01AGUQ
Chemical Name:
2-amino-N-(cyanomethyl)benzamide
CAS Number:
234444-48-5
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
MDL Number:
MFCD14604398
IUPAC Name:
2-amino-N-(cyanomethyl)benzamide
InChI:
InChI=1S/C9H9N3O/c10-5-6-12-9(13)7-3-1-2-4-8(7)11/h1-4H,6,11H2,(H,12,13)
InChI Key:
XFEBQQHQDGKLTG-UHFFFAOYSA-N
SMILES:
N#CCNC(=O)c1ccccc1N
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.075g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
175.191g/mol
Monoisotopic Mass:
175.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties