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English
(S)-Ethyl 2-hydroxy-4-phenylbutanoate
chemical compound
Ethyl (S)-2-hydroxy-4-phenylbutyrate
Ethyl (S)-alpha-hydroxybenzenebutanoate
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
208.109944372
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
Ethyl (R)-2-hydroxy-4-phenylbutyrate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₆O₃
0 references
canonical SMILES
CCOC(=O)C(O)CCc1ccccc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCOC(=O)[C@H](CCC1=CC=CC=C1)O
0 references
Identifiers
InChI
InChI=1S/C12H16O3/c1-2-15-12(14)11(13)9-8-10-6-4-3-5-7-10/h3-7,11,13H,2,8-9H2,1H3/t11-/m0/s1
0 references
InChIKey
ZJYKSSGYDPNKQS-NSHDSACASA-N
0 references
CAS Registry Number
125639-64-7
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PubChem CID
10987483
1 reference
matched by identifier from
InChIKey
InChIKey
ZJYKSSGYDPNKQS-NSHDSACASA-N
UniChem compound ID
18245024
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90450893
1 reference
matched by identifier from
InChIKey
InChIKey
ZJYKSSGYDPNKQS-NSHDSACASA-N
DSSTOX compound identifier
DTXCID80401713
0 references
UNII
2828BZ7CJW
1 reference
matched by identifier from
InChIKey
InChIKey
ZJYKSSGYDPNKQS-NSHDSACASA-N
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