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Details

Stereochemistry ACHIRAL
Molecular Formula C8H16O2
Molecular Weight 144.2114
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 4-METHYLVALERATE

SMILES

CCOC(=O)CCC(C)C

InChI

InChIKey=OFQRUTMGVBMTFQ-UHFFFAOYSA-N
InChI=1S/C8H16O2/c1-4-10-8(9)6-5-7(2)3/h7H,4-6H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C8H16O2
Molecular Weight 144.2114
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Identification based on quantitative measurements and aroma recombination of the character impact odorants in a Bavarian Pilsner-type beer.
2005 Sep 21
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:37:23 GMT 2023
Edited
by admin
on Fri Dec 15 19:37:23 GMT 2023
Record UNII
DZX6U00Q87
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 4-METHYLVALERATE
Systematic Name English
ETHYL ISOHEXANOATE
Systematic Name English
ETHYL 4-METHYLPENTANOATE [FHFI]
Common Name English
ETHYL 4-METHYLPENTANOATE
FHFI  
Systematic Name English
ETHYL ISOCAPROATE
Systematic Name English
VALERIC ACID, 4-METHYL-, ETHYL ESTER
Common Name English
PENTANOIC ACID, 4-METHYL-, ETHYL ESTER
Common Name English
FEMA NO. 4343
Code English
Code System Code Type Description
CAS
25415-67-2
Created by admin on Fri Dec 15 19:37:23 GMT 2023 , Edited by admin on Fri Dec 15 19:37:23 GMT 2023
PRIMARY
ECHA (EC/EINECS)
246-955-9
Created by admin on Fri Dec 15 19:37:23 GMT 2023 , Edited by admin on Fri Dec 15 19:37:23 GMT 2023
PRIMARY
PUBCHEM
117477
Created by admin on Fri Dec 15 19:37:23 GMT 2023 , Edited by admin on Fri Dec 15 19:37:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID6067094
Created by admin on Fri Dec 15 19:37:23 GMT 2023 , Edited by admin on Fri Dec 15 19:37:23 GMT 2023
PRIMARY
FDA UNII
DZX6U00Q87
Created by admin on Fri Dec 15 19:37:23 GMT 2023 , Edited by admin on Fri Dec 15 19:37:23 GMT 2023
PRIMARY