METHYL NERATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H18O2
Molecular Weight	182.2594
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of METHYL NERATE

Structure Search

SMILES

COC(=O)\C=C(\C)CCC=C(C)C

InChI

InChIKey=ACOBBFVLNKYODD-NTMALXAHSA-N

InChI=1S/C11H18O2/c1-9(2)6-5-7-10(3)8-11(12)13-4/h6,8H,5,7H2,1-4H3/b10-8-

HIDE SMILES / InChI

Molecular Formula	C11H18O2
Molecular Weight	182.2594
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:21:25 GMT 2025` Edited by `admin` on `Mon Mar 31 23:21:25 GMT 2025`
Record UNII	VBZ4J48WZZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METHYL NERATE

Systematic Name

English

CIS-GERANIC ACID METHYL ESTER

Preferred Name

English

2,6-OCTADIENOIC ACID, 3,7-DIMETHYL-, METHYL ESTER, (Z)-

Systematic Name

English

2,6-OCTADIENOIC ACID, 3,7-DIMETHYL-, METHYL ESTER, (2Z)-

Systematic Name

English

METHYL NEROLATE

Common Name

English

Code System Code Type Description

ECHA (EC/EINECS)

217-466-8

Created by admin on Mon Mar 31 23:21:25 GMT 2025 , Edited by admin on Mon Mar 31 23:21:25 GMT 2025

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CAS

1862-61-9

Created by admin on Mon Mar 31 23:21:25 GMT 2025 , Edited by admin on Mon Mar 31 23:21:25 GMT 2025

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PUBCHEM

5365912

Created by admin on Mon Mar 31 23:21:25 GMT 2025 , Edited by admin on Mon Mar 31 23:21:25 GMT 2025

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FDA UNII

VBZ4J48WZZ

Created by admin on Mon Mar 31 23:21:25 GMT 2025 , Edited by admin on Mon Mar 31 23:21:25 GMT 2025

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EPA CompTox

DTXSID90883763

Created by admin on Mon Mar 31 23:21:25 GMT 2025 , Edited by admin on Mon Mar 31 23:21:25 GMT 2025

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