1,1-Dimethylethyl (βS)-β-aminobenzenebutanoate
CAS Registry Number®
120686-17-1
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CAS Name
1,1-Dimethylethyl (βS)-β-aminobenzenebutanoateMolecular Formula
C14H21NO2Molecular Mass
235.32Cite this Page
1,1-Dimethylethyl (βS)-β-aminobenzenebutanoate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=120686-17-1 (retrieved ) (CAS RN: 120686-17-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
30-31 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C14H21NO2/c1-14(2,3)17-13(16)10-12(15)9-11-7-5-4-6-8-11/h4-8,12H,9-10,15H2,1-3H3/t12-/m0/s1
InChIKey
InChIKey=ZIJHIHDFXCNFAA-LBPRGKRZSA-N
SMILES
C([C@@H](CC(OC(C)(C)C)=O)N)C1=CC=CC=C1
Canonical SMILES
O=C(OC(C)(C)C)CC(N)CC=1C=CC=CC1
Other Names for this Substance
- Benzenebutanoic acid, β-amino-, 1,1-dimethylethyl ester, (βS)-
- Benzenebutanoic acid, β-amino-, 1,1-dimethylethyl ester, (S)-
- 1,1-Dimethylethyl (βS)-β-aminobenzenebutanoate
- tert-Butyl (S)-3-amino-4-phenylbutanoate
- tert-Butyl (3S)-3-amino-4-phenylbutanoate