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1262010-56-9

1262010-56-9 | [1,1'-Biphenyl]-3-carboxylic acid, 4'-fluoro-5-(trifluoromethyl)-

CAS No: 1262010-56-9 Catalog No: AG000SBV MDL No:MFCD18319087

Product Description

Catalog Number:
AG000SBV
Chemical Name:
[1,1'-Biphenyl]-3-carboxylic acid, 4'-fluoro-5-(trifluoromethyl)-
CAS Number:
1262010-56-9
Molecular Formula:
C14H8F4O2
Molecular Weight:
284.2057
MDL Number:
MFCD18319087
IUPAC Name:
3-(4-fluorophenyl)-5-(trifluoromethyl)benzoic acid
InChI:
InChI=1S/C14H8F4O2/c15-12-3-1-8(2-4-12)9-5-10(13(19)20)7-11(6-9)14(16,17)18/h1-7H,(H,19,20)
InChI Key:
GXEMQUNYBDUJCM-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1cc(cc(c1)C(F)(F)F)C(=O)O

Properties

Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.046g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
284.21g/mol
Monoisotopic Mass:
284.046g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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