(2S,3R)-3-(4-benzyloxy-2-trifluoromethyl-phenyl)-2-ethoxy-3-hydroxy-propionic acid methyl ester

HCID 69280418
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCO[C@H](C(=O)OC)[C@H](O)c1ccc(OCc2ccccc2)cc1C(F)(F)F
InChIKey
OANPODAAWMFYGH-MSOLQXFVSA-N
Molecular formula
C20H21F3O5
Average molar mass
398.4 g/mol

Names & identifiers

Preferred name
(2S,3R)-3-(4-benzyloxy-2-trifluoromethyl-phenyl)-2-ethoxy-3-hydroxy-propionic acid methyl ester
IUPAC
methyl (2S,3R)-2-ethoxy-3-hydroxy-3-[4-phenylmethoxy-2-(trifluoromethyl)phenyl]propanoate

Names & synonyms

(2S,3R)-3-(4-benzyloxy-2-trifluoromethyl-phenyl)-2-ethoxy-3-hydroxy-propionic acid methyl esterSCHEMBL5017290

Database identifiers

PubChem CID
69280418

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
65 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
9
Heavy atoms
28

Related reactions

4 records
New reaction record

Compound notes

Loading…

(2S,3R)-3-(4-benzyloxy-2-trifluoromethyl-phenyl)-2-ethoxy-3-hydroxy-propionic acid methyl ester (HCID 69280418)｜Huagongshe