6-METHYL-2-HEPTYL ACETATE

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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 6-METHYL-2-HEPTYL ACETATE

Structure Search

SMILES

CC(C)CCCC(C)OC(C)=O

InChI

InChIKey=JNRDWRMJYGDQQE-UHFFFAOYSA-N

InChI=1S/C10H20O2/c1-8(2)6-5-7-9(3)12-10(4)11/h8-9H,5-7H2,1-4H3

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

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:35:33 GMT 2025` Edited by `admin` on `Mon Mar 31 22:35:33 GMT 2025`
Record UNII	L99R8F7K2A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-HEPTANOL, 6-METHYL-, ACETATE

Preferred Name

English

6-METHYL-2-HEPTYL ACETATE

Systematic Name

English

2-HEPTANOL, 6-METHYL-, 2-ACETATE

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

267-911-5

Created by admin on Mon Mar 31 22:35:33 GMT 2025 , Edited by admin on Mon Mar 31 22:35:33 GMT 2025

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FDA UNII

L99R8F7K2A

Created by admin on Mon Mar 31 22:35:33 GMT 2025 , Edited by admin on Mon Mar 31 22:35:33 GMT 2025

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EPA CompTox

DTXSID00867413

Created by admin on Mon Mar 31 22:35:33 GMT 2025 , Edited by admin on Mon Mar 31 22:35:33 GMT 2025

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PUBCHEM

50006

Created by admin on Mon Mar 31 22:35:33 GMT 2025 , Edited by admin on Mon Mar 31 22:35:33 GMT 2025

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CAS

67952-57-2

Created by admin on Mon Mar 31 22:35:33 GMT 2025 , Edited by admin on Mon Mar 31 22:35:33 GMT 2025

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