Home Carbonyls L-Alanine, N-[(phenylmethoxy)carbonyl]-, 2-oxo-2-phenylethyl ester

L-Alanine, N-[(phenylmethoxy)carbonyl]-, 2-oxo-2-phenylethyl ester

CAS No.:
6530-41-2
Catalog Number:
AG00ECFH
Molecular Formula:
C19H19NO5
Molecular Weight:
341.3579
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Product Description
Catalog Number:
AG00ECFH
Chemical Name:
L-Alanine, N-[(phenylmethoxy)carbonyl]-, 2-oxo-2-phenylethyl ester
CAS Number:
6530-41-2
Molecular Formula:
C19H19NO5
Molecular Weight:
341.3579
MDL Number:
MFCD11455019
IUPAC Name:
(2S)-2-[phenacyl(phenylmethoxycarbonyl)amino]propanoic acid
InChI:
InChI=1S/C19H19NO5/c1-14(18(22)23)20(12-17(21)16-10-6-3-7-11-16)19(24)25-13-15-8-4-2-5-9-15/h2-11,14H,12-13H2,1H3,(H,22,23)/t14-/m0/s1
InChI Key:
MYGYWHWDNWWOLB-AWEZNQCLSA-N
SMILES:
O=C(N[C@H](C(=O)OCC(=O)c1ccccc1)C)OCc1ccccc1
Properties
Complexity:
466  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
341.126g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
341.363g/mol
Monoisotopic Mass:
341.126g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
83.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties