Home Nitros 4-Amino-3-methyl-5-nitrobenzoic acid

4-Amino-3-methyl-5-nitrobenzoic acid

CAS No.:
37901-94-3
Catalog Number:
AG019EPW
Molecular Formula:
C8H8N2O4
Molecular Weight:
196.1601
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$188
- +
250mg
95%
In Stock USA
United States
$313
- +
5g
95%
In Stock USA
United States
$565
- +
Product Description
Catalog Number:
AG019EPW
Chemical Name:
4-Amino-3-methyl-5-nitrobenzoic acid
CAS Number:
37901-94-3
Molecular Formula:
C8H8N2O4
Molecular Weight:
196.1601
MDL Number:
MFCD27950153
IUPAC Name:
4-amino-3-methyl-5-nitrobenzoic acid
InChI:
InChI=1S/C8H8N2O4/c1-4-2-5(8(11)12)3-6(7(4)9)10(13)14/h2-3H,9H2,1H3,(H,11,12)
InChI Key:
QTGYCJNEAUXQNV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(cc(c1N)C)C(=O)O
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.048g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
196.162g/mol
Monoisotopic Mass:
196.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties