HEXYL BENZOATE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H18O2
Molecular Weight	206.2808
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of HEXYL BENZOATE

Structure Search

SMILES

CCCCCCOC(=O)C1=CC=CC=C1

InChI

InChIKey=UUGLJVMIFJNVFH-UHFFFAOYSA-N

InChI=1S/C13H18O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3

HIDE SMILES / InChI

Molecular Formula	C13H18O2
Molecular Weight	206.2808
Charge	0
Count

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

Approval Year

PubMed

PubMed

Title	Date	PubMed
Development of a large-volume, membrane-based injection system for gradient elution micro-liquid chromatography.	2006 Feb 17	16213510

Patents

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:18:02 GMT 2023` Edited by `admin` on `Fri Dec 15 18:18:02 GMT 2023`
Record UNII	VR3C36EKJR
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

HEXYL BENZOATE

Systematic Name

English

N-HEXYL BENZOATE [HSDB]

Common Name

English

BENZOIC ACID HEXYL ESTER

Systematic Name

English

HEXYL BENZOATE [FHFI]

Common Name

English

N-HEXYLBENZOATE

Common Name

English

N-HEXYL BENZOATE

Common Name

English

FEMA NO. 3691

Code

English

Classification Tree Code System Code

JECFA EVALUATION

HEXYL BENZOATE

Created by admin on Fri Dec 15 18:18:02 GMT 2023 , Edited by admin on Fri Dec 15 18:18:02 GMT 2023

Code System Code Type Description

FDA UNII

VR3C36EKJR

Created by admin on Fri Dec 15 18:18:02 GMT 2023 , Edited by admin on Fri Dec 15 18:18:02 GMT 2023

PRIMARY

SMS_ID

300000017285

Created by admin on Fri Dec 15 18:18:02 GMT 2023 , Edited by admin on Fri Dec 15 18:18:02 GMT 2023

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CAS

6789-88-4

Created by admin on Fri Dec 15 18:18:02 GMT 2023 , Edited by admin on Fri Dec 15 18:18:02 GMT 2023

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EPA CompTox

DTXSID9025403

Created by admin on Fri Dec 15 18:18:02 GMT 2023 , Edited by admin on Fri Dec 15 18:18:02 GMT 2023

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JECFA MONOGRAPH

872

Created by admin on Fri Dec 15 18:18:02 GMT 2023 , Edited by admin on Fri Dec 15 18:18:02 GMT 2023

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HSDB

6031

Created by admin on Fri Dec 15 18:18:02 GMT 2023 , Edited by admin on Fri Dec 15 18:18:02 GMT 2023

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PUBCHEM

23235

Created by admin on Fri Dec 15 18:18:02 GMT 2023 , Edited by admin on Fri Dec 15 18:18:02 GMT 2023

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ECHA (EC/EINECS)

229-856-5

Created by admin on Fri Dec 15 18:18:02 GMT 2023 , Edited by admin on Fri Dec 15 18:18:02 GMT 2023

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