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Details

Stereochemistry RACEMIC
Molecular Formula C8H16O3
Molecular Weight 160.2108
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 2-HYDROXY-4-METHYLVALERATE

SMILES

CCOC(=O)C(O)CC(C)C

InChI

InChIKey=QRHOWVDPHIXNEN-UHFFFAOYSA-N
InChI=1S/C8H16O3/c1-4-11-8(10)7(9)5-6(2)3/h6-7,9H,4-5H2,1-3H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
PubMed

PubMed

TitleDatePubMed
Multidimensional chromatographic approach applied to the identification of novel aroma compounds in wine. Identification of ethyl cyclohexanoate, ethyl 2-hydroxy-3-methylbutyrate and ethyl 2-hydroxy-4-methylpentanoate.
2006 Dec 29
Patents

Patents

05994375
1
06166088
1
WO2013006738A1
1
WO2014142308A1
1
Name Type Language
ETHYL 2-HYDROXY-4-METHYLVALERATE
Systematic Name English
ETHYL LEUCATE, (±)-
Systematic Name English
PENTANOIC ACID, 2-HYDROXY-4-METHYL-, ETHYL ESTER
Systematic Name English
ETHYL 2-HYDROXYISOCAPROATE
Systematic Name English
VALERIC ACID, 2-HYDROXY-4-METHYL-, ETHYL ESTER
Systematic Name English
ETHYL 2-HYDROXY-4-METHYLPENTANOATE
Systematic Name English
ETHYL 2-HYDROXY-ISO-HEXANOATE
Systematic Name English
Code System Code Type Description
FDA UNII
3M5TB4Z168
Created by admin on Sat Dec 16 09:47:49 GMT 2023 , Edited by admin on Sat Dec 16 09:47:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID70908443
Created by admin on Sat Dec 16 09:47:49 GMT 2023 , Edited by admin on Sat Dec 16 09:47:49 GMT 2023
PRIMARY
CAS
10348-47-7
Created by admin on Sat Dec 16 09:47:49 GMT 2023 , Edited by admin on Sat Dec 16 09:47:49 GMT 2023
PRIMARY
PUBCHEM
112030
Created by admin on Sat Dec 16 09:47:49 GMT 2023 , Edited by admin on Sat Dec 16 09:47:49 GMT 2023
PRIMARY
ECHA (EC/EINECS)
233-760-9
Created by admin on Sat Dec 16 09:47:49 GMT 2023 , Edited by admin on Sat Dec 16 09:47:49 GMT 2023
PRIMARY
NIH
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