Name: Name:Benzeneacetic acid, 4-methyl-3-(trifluoromethyl)-
Brand: Angene
SKU: AG0000PJ
Rating: 90 (10 reviews)

Benzeneacetic acid, 4-methyl-3-(trifluoromethyl)-

CAS No.:

1000544-72-8

Catalog Number:

AG0000PJ

Molecular Formula:

C10H9F3O2

Molecular Weight:

218.1725

Catalog Number:

AG0000PJ

Chemical Name:

Benzeneacetic acid, 4-methyl-3-(trifluoromethyl)-

CAS Number:

1000544-72-8

Molecular Formula:

C10H9F3O2

Molecular Weight:

218.1725

MDL Number:

MFCD09832293

IUPAC Name:

2-[4-methyl-3-(trifluoromethyl)phenyl]acetic acid

InChI:

InChI=1S/C10H9F3O2/c1-6-2-3-7(5-9(14)15)4-8(6)10(11,12)13/h2-4H,5H2,1H3,(H,14,15)

InChI Key:

GDCOLUWREQNZSM-UHFFFAOYSA-N

SMILES:

OC(=O)Cc1ccc(c(c1)C(F)(F)F)C

Complexity:

237

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

218.055g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

218.175g/mol

Monoisotopic Mass:

218.055g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6