Name: Name:(S)-3-(1-Amino-2,2,2-trifluoroethyl)benzoic acid hydrochloride
Brand: Angene
SKU: AG01DU7K
Rating: 90 (10 reviews)

(S)-3-(1-Amino-2,2,2-trifluoroethyl)benzoic acid hydrochloride

CAS No.:

1391384-65-8

Catalog Number:

AG01DU7K

Molecular Formula:

C9H9ClF3NO2

Molecular Weight:

255.6215

Catalog Number:

AG01DU7K

Chemical Name:

(S)-3-(1-Amino-2,2,2-trifluoroethyl)benzoic acid hydrochloride

CAS Number:

1391384-65-8

Molecular Formula:

C9H9ClF3NO2

Molecular Weight:

255.6215

MDL Number:

MFCD12757419

IUPAC Name:

3-[(1S)-1-amino-2,2,2-trifluoroethyl]benzoic acid;hydrochloride

InChI:

InChI=1S/C9H8F3NO2.ClH/c10-9(11,12)7(13)5-2-1-3-6(4-5)8(14)15;/h1-4,7H,13H2,(H,14,15);1H/t7-;/m0./s1

InChI Key:

PGVLYBVVIMPTQZ-FJXQXJEOSA-N

SMILES:

N[C@H](C(F)(F)F)c1cccc(c1)C(=O)O.Cl

Complexity:

242

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

255.027g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

255.621g/mol

Monoisotopic Mass:

255.027g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: