BIS(CYCLOHEX-3-EN-1-YLMETHYL) HEXANEDIOATE

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	MIXED
Molecular Formula	C20H30O4
Molecular Weight	334.4498
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BIS(CYCLOHEX-3-EN-1-YLMETHYL) HEXANEDIOATE

Structure Search

SMILES

O=C(CCCCC(=O)OCC1CCC=CC1)OCC2CCC=CC2

InChI

InChIKey=PJRVYFKLOAROIV-UHFFFAOYSA-N

InChI=1S/C20H30O4/c21-19(23-15-17-9-3-1-4-10-17)13-7-8-14-20(22)24-16-18-11-5-2-6-12-18/h1-3,5,17-18H,4,6-16H2

HIDE SMILES / InChI

Molecular Formula	C20H30O4
Molecular Weight	334.4498
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:50:15 GMT 2023` Edited by `admin` on `Sat Dec 16 15:50:15 GMT 2023`
Record UNII	JTT32FQ8ZM
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BIS(CYCLOHEX-3-EN-1-YLMETHYL) HEXANEDIOATE

Systematic Name

English

HEXANEDIOIC ACID, 1,6-BIS(3-CYCLOHEXEN-1-YLMETHYL) ESTER

Systematic Name

English

Code System Code Type Description

FDA UNII

JTT32FQ8ZM

Created by admin on Sat Dec 16 15:50:15 GMT 2023 , Edited by admin on Sat Dec 16 15:50:15 GMT 2023

PRIMARY

ECHA (EC/EINECS)

264-555-2

Created by admin on Sat Dec 16 15:50:15 GMT 2023 , Edited by admin on Sat Dec 16 15:50:15 GMT 2023

PRIMARY

CAS

63905-29-3

Created by admin on Sat Dec 16 15:50:15 GMT 2023 , Edited by admin on Sat Dec 16 15:50:15 GMT 2023

PRIMARY

PUBCHEM

45071

Created by admin on Sat Dec 16 15:50:15 GMT 2023 , Edited by admin on Sat Dec 16 15:50:15 GMT 2023

PRIMARY

EPA CompTox

DTXSID6052322

Created by admin on Sat Dec 16 15:50:15 GMT 2023 , Edited by admin on Sat Dec 16 15:50:15 GMT 2023

PRIMARY