Home Other Building Blocks 2-(4-Nitrophenyl)benzoic acid

2-(4-Nitrophenyl)benzoic acid

CAS No.:
18211-41-1
Catalog Number:
AG0023DR
Molecular Formula:
C13H9NO4
Molecular Weight:
243.2149
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$188
- +
5g
96%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG0023DR
Chemical Name:
2-(4-Nitrophenyl)benzoic acid
CAS Number:
18211-41-1
Molecular Formula:
C13H9NO4
Molecular Weight:
243.2149
MDL Number:
MFCD00445193
IUPAC Name:
2-(4-nitrophenyl)benzoic acid
InChI:
InChI=1S/C13H9NO4/c15-13(16)12-4-2-1-3-11(12)9-5-7-10(8-6-9)14(17)18/h1-8H,(H,15,16)
InChI Key:
IVKKQTQLZURECG-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)c1ccccc1C(=O)O
NSC Number:
86911
Properties
Complexity:
317  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.053g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.218g/mol
Monoisotopic Mass:
243.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties