4-METHYLNONANOIC ACID

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C10H20O2
Molecular Weight	172.2646
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-METHYLNONANOIC ACID

Structure Search

SMILES

CCCCCC(C)CCC(O)=O

InChI

InChIKey=WQTZCQIRCYSUBQ-UHFFFAOYSA-N

InChI=1S/C10H20O2/c1-3-4-5-6-9(2)7-8-10(11)12/h9H,3-8H2,1-2H3,(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C10H20O2
Molecular Weight	172.2646
Charge	0
Count

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

Approval Year

PubMed

PubMed

Title	Date	PubMed
In vitro assay for sex pheromone biosynthesis by the female yellow mealworm beetle and identification of a regulated step.	2006-05	16651187

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:52:02 GMT 2025` Edited by `admin` on `Mon Mar 31 19:52:02 GMT 2025`
Record UNII	5BKU622F1K
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

FEMA NO. 3574

Preferred Name

English

4-METHYLNONANOIC ACID

Systematic Name

English

4-METHYLNONANOIC ACID, (±)-

Common Name

English

4-METHYLNONANOIC ACID [FHFI]

Common Name

English

NONANOIC ACID, 4-METHYL-

Common Name

English

(±)-4-METHYLNONANOIC ACID

Systematic Name

English

4-METHYL NONANOIC ACID

Systematic Name

English

4-METHYLPELARGONIC ACID

Systematic Name

English

Classification Tree Code System Code

JECFA EVALUATION

4-METHYLNONANOIC ACID

Created by admin on Mon Mar 31 19:52:02 GMT 2025 , Edited by admin on Mon Mar 31 19:52:02 GMT 2025

Code System Code Type Description

JECFA MONOGRAPH

404

Created by admin on Mon Mar 31 19:52:02 GMT 2025 , Edited by admin on Mon Mar 31 19:52:02 GMT 2025

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CAS

45019-28-1

Created by admin on Mon Mar 31 19:52:02 GMT 2025 , Edited by admin on Mon Mar 31 19:52:02 GMT 2025

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FDA UNII

5BKU622F1K

Created by admin on Mon Mar 31 19:52:02 GMT 2025 , Edited by admin on Mon Mar 31 19:52:02 GMT 2025

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PUBCHEM

62003

Created by admin on Mon Mar 31 19:52:02 GMT 2025 , Edited by admin on Mon Mar 31 19:52:02 GMT 2025

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EPA CompTox

DTXSID80866121

Created by admin on Mon Mar 31 19:52:02 GMT 2025 , Edited by admin on Mon Mar 31 19:52:02 GMT 2025

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ECHA (EC/EINECS)

256-180-8

Created by admin on Mon Mar 31 19:52:02 GMT 2025 , Edited by admin on Mon Mar 31 19:52:02 GMT 2025

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