3-HEXYL-5-(3,4-METHYLENEDIOXYPHENYL)-2-CYCLOHEXEN-1-ONE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H24O3
Molecular Weight	300.3921
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-HEXYL-5-(3,4-METHYLENEDIOXYPHENYL)-2-CYCLOHEXEN-1-ONE

Structure Search

SMILES

CCCCCCC1=CC(=O)CC(C1)C2=CC3=C(OCO3)C=C2

InChI

InChIKey=JBVNWTXRFKZNBQ-UHFFFAOYSA-N

InChI=1S/C19H24O3/c1-2-3-4-5-6-14-9-16(11-17(20)10-14)15-7-8-18-19(12-15)22-13-21-18/h7-8,10,12,16H,2-6,9,11,13H2,1H3

HIDE SMILES / InChI

Molecular Formula	C19H24O3
Molecular Weight	300.3921
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 `Sat Dec 16 08:54:13 GMT 2023` Edited by `admin` on `Sat Dec 16 08:54:13 GMT 2023`
Record UNII	RV88204E3P
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-HEXYL-5-(3,4-METHYLENEDIOXYPHENYL)-2-CYCLOHEXEN-1-ONE

Systematic Name

English

PIPERONYL CYCLONENE

Common Name

English

2-CYCLOHEXEN-1-ONE, 5-(1,3-BENZODIOXOL-5-YL)-3-HEXYL-

Systematic Name

English

PIPERONYL CYCLOHEXENONE

Systematic Name

English

5-(1,3-BENZODIOXOL-5-YL)-3-HEXYLCYCLOHEX-2-EN-1-ONE

Systematic Name

English

ENT-2818

Code

English

(±)-3-HEXYL-5-(3,4-METHYLENEDIOXYPHENYL)-2-CYCLOHEXEN-1-ONE

Systematic Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

202100

Created by admin on Sat Dec 16 08:54:13 GMT 2023 , Edited by admin on Sat Dec 16 08:54:13 GMT 2023

Code System Code Type Description

ALANWOOD

piperonyl cyclonene

Created by admin on Sat Dec 16 08:54:13 GMT 2023 , Edited by admin on Sat Dec 16 08:54:13 GMT 2023

PRIMARY

CAS

8066-12-4

Created by admin on Sat Dec 16 08:54:13 GMT 2023 , Edited by admin on Sat Dec 16 08:54:13 GMT 2023

NO STRUCTURE GIVEN

EPA CompTox

DTXSID40107840

Created by admin on Sat Dec 16 08:54:13 GMT 2023 , Edited by admin on Sat Dec 16 08:54:13 GMT 2023

PRIMARY

PUBCHEM

8410

Created by admin on Sat Dec 16 08:54:13 GMT 2023 , Edited by admin on Sat Dec 16 08:54:13 GMT 2023

PRIMARY

CAS

119-89-1

Created by admin on Sat Dec 16 08:54:13 GMT 2023 , Edited by admin on Sat Dec 16 08:54:13 GMT 2023

PRIMARY

FDA UNII

RV88204E3P

Created by admin on Sat Dec 16 08:54:13 GMT 2023 , Edited by admin on Sat Dec 16 08:54:13 GMT 2023

PRIMARY