Home Carbonyls 3-(3-Methoxycarbonylphenyl)-5-nitrobenzoic acid

3-(3-Methoxycarbonylphenyl)-5-nitrobenzoic acid

CAS No.:
1261908-88-6
Catalog Number:
AG00HKOO
Molecular Formula:
C15H11NO6
Molecular Weight:
301.2509
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$300
- +
5g
95%
In Stock USA
United States
$1000
- +
Product Description
Catalog Number:
AG00HKOO
Chemical Name:
3-(3-Methoxycarbonylphenyl)-5-nitrobenzoic acid
CAS Number:
1261908-88-6
Molecular Formula:
C15H11NO6
Molecular Weight:
301.2509
MDL Number:
MFCD18321217
IUPAC Name:
3-(3-methoxycarbonylphenyl)-5-nitrobenzoic acid
InChI:
InChI=1S/C15H11NO6/c1-22-15(19)10-4-2-3-9(5-10)11-6-12(14(17)18)8-13(7-11)16(20)21/h2-8H,1H3,(H,17,18)
InChI Key:
PWINGVGBNUZPNV-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1)c1cc(cc(c1)C(=O)O)[N+](=O)[O-]
Properties
Complexity:
446  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.059g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
301.254g/mol
Monoisotopic Mass:
301.059g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties