METHYL 3-HYDROXYHEXANOATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C7H14O3
Molecular Weight	146.1843
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCC(O)CC(=O)OC

InChI

InChIKey=ACCRBMDJCPPJDX-UHFFFAOYSA-N

InChI=1S/C7H14O3/c1-3-4-6(8)5-7(9)10-2/h6,8H,3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C7H14O3
Molecular Weight	146.1843
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

PubMed

Title	Date	PubMed
Integrating heterogeneous odor response data into a common response model: A DoOR to the complete olfactome.	2010 Sep	20530377

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:51:08 GMT 2023` Edited by `admin` on `Fri Dec 15 19:51:08 GMT 2023`
Record UNII	8H646ZUC4E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METHYL 3-HYDROXYHEXANOATE

Systematic Name

English

METHYL 3-HYDROXYHEXANOATE, (±)-

Systematic Name

English

METHYL .BETA.-HYDROXYHEXANOATE

Systematic Name

English

FEMA NO. 3508

Code

English

METHYL 3-HYDROXYCAPROATE

Systematic Name

English

(±)-METHYL 3-HYDROXYHEXANOATE

Systematic Name

English

METHYL .BETA.-HYDROXYCAPROATE

Systematic Name

English

METHYL 3-HYDROXYHEXANOATE [FHFI]

Common Name

English

PINEAPPLE HYDROXYHEXANOATE

Common Name

English

HEXANOIC ACID, 3-HYDROXY-, METHYL ESTER

Common Name

English

Classification Tree Code System Code

JECFA EVALUATION

METHYL 3-HYDROXYHEXANOATE