Home Carboxys 2'-Hydroxy-3'-nitro-[1,1'-biphenyl]-3-carboxylic acid

2'-Hydroxy-3'-nitro-[1,1'-biphenyl]-3-carboxylic acid

CAS No.:
376591-95-6
Catalog Number:
AG0078EP
Molecular Formula:
C13H9NO5
Molecular Weight:
259.2143
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Product Description
Catalog Number:
AG0078EP
Chemical Name:
2'-Hydroxy-3'-nitro-[1,1'-biphenyl]-3-carboxylic acid
CAS Number:
376591-95-6
Molecular Formula:
C13H9NO5
Molecular Weight:
259.2143
MDL Number:
MFCD10001466
IUPAC Name:
3-(2-hydroxy-3-nitrophenyl)benzoic acid
InChI:
InChI=1S/C13H9NO5/c15-12-10(5-2-6-11(12)14(18)19)8-3-1-4-9(7-8)13(16)17/h1-7,15H,(H,16,17)
InChI Key:
JCFPSTQCDAZKJN-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1)c1cccc(c1O)[N+](=O)[O-]
Properties
Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.048g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
259.217g/mol
Monoisotopic Mass:
259.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties