CYCLOTENE BUTYRATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H14O3
Molecular Weight	182.2164
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of CYCLOTENE BUTYRATE

Structure Search

SMILES

CCCC(=O)OC1=C(C)CCC1=O

InChI

InChIKey=SUJWBOKDKMEAOQ-UHFFFAOYSA-N

InChI=1S/C10H14O3/c1-3-4-9(12)13-10-7(2)5-6-8(10)11/h3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C10H14O3
Molecular Weight	182.2164
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 `Fri Dec 15 18:50:49 GMT 2023` Edited by `admin` on `Fri Dec 15 18:50:49 GMT 2023`
Record UNII	AQY4Q6ZUD4
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CYCLOTENE BUTYRATE

Common Name

English

BUTANOIC ACID, 2-METHYL-5-OXO-1-CYCLOPENTEN-1-YL ESTER

Common Name

English

2-METHYL-5-OXO-1-CYCLOPENTEN-1-YL BUTYRATE

Systematic Name

English

BUTYRIC ACID, 2-METHYL-5-OXO-1-CYCLOPENTEN-1-YL ESTER

Common Name

English

2-HYDROXY-3-METHYL-2-CYCLOPENTEN-1-ONE BUTYRATE

Systematic Name

English

FEMA NO. 4648

Code

English

Classification Tree Code System Code

JECFA EVALUATION

CYCLOTENE BUTYRATE

Created by admin on Fri Dec 15 18:50:49 GMT 2023 , Edited by admin on Fri Dec 15 18:50:49 GMT 2023

Code System Code Type Description

ECHA (EC/EINECS)

269-363-2

Created by admin on Fri Dec 15 18:50:49 GMT 2023 , Edited by admin on Fri Dec 15 18:50:49 GMT 2023

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JECFA MONOGRAPH

2033

Created by admin on Fri Dec 15 18:50:49 GMT 2023 , Edited by admin on Fri Dec 15 18:50:49 GMT 2023

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FDA UNII

AQY4Q6ZUD4

Created by admin on Fri Dec 15 18:50:49 GMT 2023 , Edited by admin on Fri Dec 15 18:50:49 GMT 2023

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CAS

68227-51-0

Created by admin on Fri Dec 15 18:50:49 GMT 2023 , Edited by admin on Fri Dec 15 18:50:49 GMT 2023

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EPA CompTox

DTXSID2071289

Created by admin on Fri Dec 15 18:50:49 GMT 2023 , Edited by admin on Fri Dec 15 18:50:49 GMT 2023

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PUBCHEM

109828

Created by admin on Fri Dec 15 18:50:49 GMT 2023 , Edited by admin on Fri Dec 15 18:50:49 GMT 2023

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