Name: Name:2-chloro-4-(2,2,2-trifluoroethoxy)benzoic acid
Brand: Angene
SKU: AG01DHSQ
Rating: 90 (10 reviews)

2-chloro-4-(2,2,2-trifluoroethoxy)benzoic acid

CAS No.:

888022-63-7

Catalog Number:

AG01DHSQ

Molecular Formula:

C9H6ClF3O3

Molecular Weight:

254.5903

Catalog Number:

AG01DHSQ

Chemical Name:

2-chloro-4-(2,2,2-trifluoroethoxy)benzoic acid

CAS Number:

888022-63-7

Molecular Formula:

C9H6ClF3O3

Molecular Weight:

254.5903

MDL Number:

MFCD17256594

IUPAC Name:

2-chloro-4-(2,2,2-trifluoroethoxy)benzoic acid

InChI:

InChI=1S/C9H6ClF3O3/c10-7-3-5(16-4-9(11,12)13)1-2-6(7)8(14)15/h1-3H,4H2,(H,14,15)

InChI Key:

GOZXORRGNFHRGE-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc(cc1Cl)OCC(F)(F)F

Complexity:

257

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

253.996g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.589g/mol

Monoisotopic Mass:

253.996g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3