Name: Name:Benzeneacetic acid, 4-fluoro-α-[(phenylmethyl)amino]-, (αS)-
Brand: Angene
SKU: AG001RBW
Rating: 90 (10 reviews)

Benzeneacetic acid, 4-fluoro-α-[(phenylmethyl)amino]-, (αS)-

CAS No.:

159707-18-3

Catalog Number:

AG001RBW

Molecular Formula:

C15H14FNO2

Molecular Weight:

259.2756

Catalog Number:

AG001RBW

Chemical Name:

Benzeneacetic acid, 4-fluoro-α-[(phenylmethyl)amino]-, (αS)-

CAS Number:

159707-18-3

Molecular Formula:

C15H14FNO2

Molecular Weight:

259.2756

MDL Number:

MFCD08458062

IUPAC Name:

(2S)-2-(benzylamino)-2-(4-fluorophenyl)acetic acid

InChI:

InChI=1S/C15H14FNO2/c16-13-8-6-12(7-9-13)14(15(18)19)17-10-11-4-2-1-3-5-11/h1-9,14,17H,10H2,(H,18,19)/t14-/m0/s1

InChI Key:

KGMFSTPSQOLFGB-AWEZNQCLSA-N

SMILES:

OC(=O)[C@H](c1ccc(cc1)F)NCc1ccccc1

Complexity:

284

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

259.101g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

259.28g/mol

Monoisotopic Mass:

259.101g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.4