Name: Name:2-(4-chlorophenyl)-4,4,4-trifluorobutanoic acid
Brand: Angene
SKU: AG01BP9F
Rating: 90 (10 reviews)

2-(4-chlorophenyl)-4,4,4-trifluorobutanoic acid

CAS No.:

1511647-92-9

Catalog Number:

AG01BP9F

Molecular Formula:

C10H8ClF3O2

Molecular Weight:

252.6175

Catalog Number:

AG01BP9F

Chemical Name:

2-(4-chlorophenyl)-4,4,4-trifluorobutanoic acid

CAS Number:

1511647-92-9

Molecular Formula:

C10H8ClF3O2

Molecular Weight:

252.6175

MDL Number:

MFCD21925948

IUPAC Name:

2-(4-chlorophenyl)-4,4,4-trifluorobutanoic acid

InChI:

InChI=1S/C10H8ClF3O2/c11-7-3-1-6(2-4-7)8(9(15)16)5-10(12,13)14/h1-4,8H,5H2,(H,15,16)

InChI Key:

KBJFHBNOYKJZDB-UHFFFAOYSA-N

SMILES:

OC(=O)C(c1ccc(cc1)Cl)CC(F)(F)F

Complexity:

247

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

252.016g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

252.617g/mol

Monoisotopic Mass:

252.016g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5