Home Carboxys [1,1'-Biphenyl]-4-carboxylic acid, 4-nitrophenyl ester

[1,1'-Biphenyl]-4-carboxylic acid, 4-nitrophenyl ester

CAS No.:
35666-12-7
Catalog Number:
AG00I72Z
Molecular Formula:
C19H13NO4
Molecular Weight:
319.3108
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Product Description
Catalog Number:
AG00I72Z
Chemical Name:
[1,1'-Biphenyl]-4-carboxylic acid, 4-nitrophenyl ester
CAS Number:
35666-12-7
Molecular Formula:
C19H13NO4
Molecular Weight:
319.3108
MDL Number:
MFCD00566446
IUPAC Name:
(4-nitrophenyl) 4-phenylbenzoate
InChI:
InChI=1S/C19H13NO4/c21-19(24-18-12-10-17(11-13-18)20(22)23)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-13H
InChI Key:
BCHPTAXOHHMTJW-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)c1ccccc1)Oc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
425  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.084g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.316g/mol
Monoisotopic Mass:
319.084g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  
Properties