L-Aspartic acid, N-[(phenylmethoxy)carbonyl]-, 4-(1,1-dimethylethyl) ester, hydrate (1:1)
CAS Registry Number®
229957-50-0
CAS Name
L-Aspartic acid, N-[(phenylmethoxy)carbonyl]-, 4-(1,1-dimethylethyl) ester, hydrate (1:1)Molecular Formula
C16H21NO6.H2OCite this Page
L-Aspartic acid, N-[(phenylmethoxy)carbonyl]-, 4-(1,1-dimethylethyl) ester, hydrate (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=229957-50-0 (retrieved ) (CAS RN: 229957-50-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C16H21NO6.H2O/c1-16(2,3)23-13(18)9-12(14(19)20)17-15(21)22-10-11-7-5-4-6-8-11;/h4-8,12H,9-10H2,1-3H3,(H,17,21)(H,19,20);1H2/t12-;/m0./s1
InChIKey
InChIKey=UWDOQNWFLPMMLQ-YDALLXLXSA-N
SMILES
C(OC(N[C@@H](CC(OC(C)(C)C)=O)C(O)=O)=O)C1=CC=CC=C1.O
Canonical SMILES
O=C(OCC=1C=CC=CC1)NC(C(=O)O)CC(=O)OC(C)(C)C.O
Other Names for this Substance
- L-Aspartic acid, N-[(phenylmethoxy)carbonyl]-, 4-(1,1-dimethylethyl) ester, hydrate (1:1)
- L-Aspartic acid, N-[(phenylmethoxy)carbonyl]-, 4-(1,1-dimethylethyl) ester, monohydrate
- (S)-2-(((Benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanoic acid hydrate
