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148401-41-6

148401-41-6 | Benzeneacetic acid, 4-[4-(trifluoromethyl)phenoxy]-

CAS No: 148401-41-6 Catalog No: AG001KWC MDL No:

Product Description

Catalog Number:
AG001KWC
Chemical Name:
Benzeneacetic acid, 4-[4-(trifluoromethyl)phenoxy]-
CAS Number:
148401-41-6
Molecular Formula:
C15H11F3O3
Molecular Weight:
296.2412
IUPAC Name:
2-[4-[4-(trifluoromethyl)phenoxy]phenyl]acetic acid
InChI:
InChI=1S/C15H11F3O3/c16-15(17,18)11-3-7-13(8-4-11)21-12-5-1-10(2-6-12)9-14(19)20/h1-8H,9H2,(H,19,20)
InChI Key:
JRTULMQCKMTDED-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(cc1)Oc1ccc(cc1)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:
296.066g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.245g/mol
Monoisotopic Mass:
296.066g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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