Home Nitros 4-Hydroxy-2-methyl-5-nitrobenzoic acid

4-Hydroxy-2-methyl-5-nitrobenzoic acid

CAS No.:
408335-80-8
Catalog Number:
AG00C6WF
Molecular Formula:
C8H7NO5
Molecular Weight:
197.1449
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$1312
- +
Product Description
Catalog Number:
AG00C6WF
Chemical Name:
4-Hydroxy-2-methyl-5-nitrobenzoic acid
CAS Number:
408335-80-8
Molecular Formula:
C8H7NO5
Molecular Weight:
197.1449
MDL Number:
MFCD18826158
IUPAC Name:
4-hydroxy-2-methyl-5-nitrobenzoic acid
InChI:
InChI=1S/C8H7NO5/c1-4-2-7(10)6(9(13)14)3-5(4)8(11)12/h2-3,10H,1H3,(H,11,12)
InChI Key:
LIDKLIGKTGJHFK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(C(=O)O)c(cc1O)C
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.032g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
197.146g/mol
Monoisotopic Mass:
197.032g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties