(2S)-3-(4-benzyloxy-phenyl)-2-propoxy-propionic acid ethyl ester

HCID 58822945
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCO[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)OCC
InChIKey
RSXMXOQQXHDZSN-FQEVSTJZSA-N
Molecular formula
C21H26O4
Average molar mass
342.4 g/mol
Monoisotopic mass
342.18310931

Names & identifiers

Preferred name
(2S)-3-(4-benzyloxy-phenyl)-2-propoxy-propionic acid ethyl ester
IUPAC
ethyl (2S)-3-(4-phenylmethoxyphenyl)-2-propoxypropanoate

Names & synonyms

SCHEMBL5377710RSXMXOQQXHDZSN-FQEVSTJZSA-N(2S)-3-(4-benzyloxy-phenyl)-2-propoxy-propionic acid ethyl ester

Database identifiers

PubChem CID
58822945

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
25

Related reactions

2 records
New reaction record

Compound notes

Loading…