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1224742-15-7 | [1,1'-Biphenyl]-3-acetic acid, 3'-(trifluoromethyl)-
CAS No: 1224742-15-7 Catalog No: AG0017AO MDL No:MFCD05980213
Product Description
Catalog Number:
AG0017AO
Chemical Name:
[1,1'-Biphenyl]-3-acetic acid, 3'-(trifluoromethyl)-
CAS Number:
1224742-15-7
Molecular Formula:
C15H11F3O2
Molecular Weight:
280.2418
MDL Number:
MFCD05980213
IUPAC Name:
2-[3-[3-(trifluoromethyl)phenyl]phenyl]acetic acid
InChI:
InChI=1S/C15H11F3O2/c16-15(17,18)13-6-2-5-12(9-13)11-4-1-3-10(7-11)8-14(19)20/h1-7,9H,8H2,(H,19,20)
InChI Key:
VQRUXJYTJUYMPY-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cccc(c1)c1cccc(c1)C(F)(F)F
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.071g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
280.246g/mol
Monoisotopic Mass:
280.071g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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