Home Other Building Blocks 2-Amino-5-cyanobenzoic acid

2-Amino-5-cyanobenzoic acid

CAS No.:
99767-45-0
Catalog Number:
AG00369J
Molecular Formula:
C8H6N2O2
Molecular Weight:
162.1454
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$113
- +
5g
96%
In Stock USA
United States
$463
- +
10g
96%
In Stock USA
United States
$850
- +
25g
96%
In Stock USA
United States
$1725
- +
Product Description
Catalog Number:
AG00369J
Chemical Name:
2-Amino-5-cyanobenzoic acid
CAS Number:
99767-45-0
Molecular Formula:
C8H6N2O2
Molecular Weight:
162.1454
MDL Number:
MFCD20485816
IUPAC Name:
2-amino-5-cyanobenzoic acid
InChI:
InChI=1S/C8H6N2O2/c9-4-5-1-2-7(10)6(3-5)8(11)12/h1-3H,10H2,(H,11,12)
InChI Key:
HQNZNIJPAYTWJK-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)C(=O)O)N
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:
0.7  
Properties