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

4-Hydroxy-3-methyl-5-nitrobenzoic acid

CAS No.:
861315-61-9
Catalog Number:
AG00IDX7
Molecular Formula:
C8H7NO5
Molecular Weight:
197.1449
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$107
- +
1g
95%
In Stock USA
United States
$269
- +
5g
95%
In Stock USA
United States
$875
- +
10g
95%
In Stock USA
United States
$1294
- +
Product Description
Catalog Number:
AG00IDX7
Chemical Name:
4-Hydroxy-3-methyl-5-nitrobenzoic acid
CAS Number:
861315-61-9
Molecular Formula:
C8H7NO5
Molecular Weight:
197.1449
MDL Number:
MFCD27930252
IUPAC Name:
4-hydroxy-3-methyl-5-nitrobenzoic acid
InChI:
InChI=1S/C8H7NO5/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14/h2-3,10H,1H3,(H,11,12)
InChI Key:
AUQMLPTXBVNUBP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(cc(c1O)C)C(=O)O
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