(3S,alphaS)-t-Butyl 3-(alpha-methylbenzylamino)-3-phenylpropionate

HCID 15344490
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Basic information

Standard SMILES
C[C@H](N[C@@H](CC(=O)OC(C)(C)C)c1ccccc1)c1ccccc1
InChIKey
XSGZMPZHCHKKDP-LPHOPBHVSA-N
Molecular formula
C21H27NO2
Average molar mass
325.4 g/mol
Monoisotopic mass
325.2041791

Names & identifiers

Preferred name
(3S,alphaS)-t-Butyl 3-(alpha-methylbenzylamino)-3-phenylpropionate
IUPAC
tert-butyl (3S)-3-phenyl-3-[[(1S)-1-phenylethyl]amino]propanoate

Names & synonyms

XSGZMPZHCHKKDP-LPHOPBHVSA-N(3S,alphaS)-t-Butyl 3-(alpha-methylbenzylamino)-3-phenylpropionate

Database identifiers

PubChem CID
15344490
Nikkaji
J830.223E

Properties

Computed structural properties

XLogP
4
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
24

Related reactions

2 records
New reaction record

Compound notes

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