AMYL HEXANOATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H22O2
Molecular Weight	186.2912
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCCOC(=O)CCCCC

InChI

InChIKey=WRFZKAGPPQGDDQ-UHFFFAOYSA-N

InChI=1S/C11H22O2/c1-3-5-7-9-11(12)13-10-8-6-4-2/h3-10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C11H22O2
Molecular Weight	186.2912
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Identification of female sex pheromone of the rice leaf bug, Trigonotylus caelestialium.	2001 Dec	11789951
Investigations of aroma volatile biosynthesis under anoxic conditions and in different tissues of "Redchief Delicious" apple fruit (Malus domestica Borkh.).	2002 Apr 24	11958633
Modelling substrate specificity and enantioselectivity for lipases and esterases by substrate-imprinted docking.	2009 Jun 3	19493341

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:41:21 GMT 2023` Edited by `admin` on `Fri Dec 15 18:41:21 GMT 2023`
Record UNII	5M61M1AL1H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AMYL HEXANOATE

Systematic Name

English

PENTYL HEXANOATE

Systematic Name

English

HEXANOIC ACID, PENTYL ESTER

Common Name

English

N-AMYL CAPROATE

Common Name

English

AMYL CAPRONATE

Common Name

English

NSC-46119

Code

English

AMYL HEXANOATE [FHFI]

Common Name

English

FEMA NO. 2074

Code

English

N-AMYL CAPROATE [MI]

Common Name

English

Classification Tree Code System Code

JECFA EVALUATION

N-AMYL HEXANOATE