Home Carboxys 4'-Nitrobiphenyl-3-carboxylic acid

4'-Nitrobiphenyl-3-carboxylic acid

CAS No.:
729-01-1
Catalog Number:
AG003LUB
Molecular Formula:
C13H9NO4
Molecular Weight:
243.2149
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$313
- +
5g
96%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG003LUB
Chemical Name:
4'-Nitrobiphenyl-3-carboxylic acid
CAS Number:
729-01-1
Molecular Formula:
C13H9NO4
Molecular Weight:
243.2149
MDL Number:
MFCD11895693
IUPAC Name:
3-(4-nitrophenyl)benzoic acid
InChI:
InChI=1S/C13H9NO4/c15-13(16)11-3-1-2-10(8-11)9-4-6-12(7-5-9)14(17)18/h1-8H,(H,15,16)
InChI Key:
ZWQRSJSVYWEXHN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)c1cccc(c1)C(=O)O
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:
3.4  
Properties