Computed Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
162.148g/mol
Monoisotopic Mass:
162.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Synonyms
3-AMINO-5-CYANOBENZOIC ACID
1000341-18-3
W-1069
3-amino-5-cyano-benzoic acid methyl ester
199536-01-1
3-Amino-5-cyanorobenzoic acid
Benzoic acid, 3-amino-5-cyano-
SCHEMBL13674520
ZINC14985993
AKOS006330681
AB50174
CS-13384
CS-0030477
