HEXYL CYCLOHEXANECARBOXYLATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H24O2
Molecular Weight	212.3285
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of HEXYL CYCLOHEXANECARBOXYLATE

Structure Search

SMILES

CCCCCCOC(=O)C1CCCCC1

InChI

InChIKey=QNVYTFRSSXVBQH-UHFFFAOYSA-N

InChI=1S/C13H24O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h12H,2-11H2,1H3

HIDE SMILES / InChI

Molecular Formula	C13H24O2
Molecular Weight	212.3285
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:24:31 GMT 2025` Edited by `admin` on `Tue Apr 01 19:24:31 GMT 2025`
Record UNII	X2B95HSA5C
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

HEXYL CYCLOHEXANECARBOXYLATE

Systematic Name

English

1-HEXANOL CYCLOHEXANECARBOXYLATE

Preferred Name

English

CYCLOHEXANECARBOXYLIC ACID, HEXYL ESTER

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID60182230

Created by admin on Tue Apr 01 19:24:31 GMT 2025 , Edited by admin on Tue Apr 01 19:24:31 GMT 2025

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ECHA (EC/EINECS)

248-744-7

Created by admin on Tue Apr 01 19:24:31 GMT 2025 , Edited by admin on Tue Apr 01 19:24:31 GMT 2025

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FDA UNII

X2B95HSA5C

Created by admin on Tue Apr 01 19:24:31 GMT 2025 , Edited by admin on Tue Apr 01 19:24:31 GMT 2025

PRIMARY

PUBCHEM

119761

Created by admin on Tue Apr 01 19:24:31 GMT 2025 , Edited by admin on Tue Apr 01 19:24:31 GMT 2025

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CAS

27948-10-3

Created by admin on Tue Apr 01 19:24:31 GMT 2025 , Edited by admin on Tue Apr 01 19:24:31 GMT 2025

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