Name: Name:(S)-2-(((Benzyloxy)carbonyl)amino)-3-(2-fluorophenyl)propanoic acid
Brand: Angene
SKU: AG000XHU
Rating: 90 (10 reviews)

(S)-2-(((Benzyloxy)carbonyl)amino)-3-(2-fluorophenyl)propanoic acid

CAS No.:

127862-88-8

Catalog Number:

AG000XHU

Molecular Formula:

C17H16FNO4

Molecular Weight:

317.3116

Catalog Number:

AG000XHU

Chemical Name:

(S)-2-(((Benzyloxy)carbonyl)amino)-3-(2-fluorophenyl)propanoic acid

CAS Number:

127862-88-8

Molecular Formula:

C17H16FNO4

Molecular Weight:

317.3116

MDL Number:

MFCD00797567

IUPAC Name:

(2S)-3-(2-fluorophenyl)-2-(phenylmethoxycarbonylamino)propanoic acid

InChI:

InChI=1S/C17H16FNO4/c18-14-9-5-4-8-13(14)10-15(16(20)21)19-17(22)23-11-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,19,22)(H,20,21)/t15-/m0/s1

InChI Key:

GYJREHMTTLYKRJ-HNNXBMFYSA-N

SMILES:

O=C(N[C@H](C(=O)O)Cc1ccccc1F)OCc1ccccc1

Complexity:

398

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

317.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

317.316g/mol

Monoisotopic Mass:

317.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1