2-Methylbutan-2-yl benzenecarboperoxoate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H16O3
Molecular Weight	208.2536
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-Methylbutan-2-yl benzenecarboperoxoate

Structure Search

SMILES

CCC(C)(C)OOC(=O)C1=CC=CC=C1

InChI

InChIKey=RFSCGDQQLKVJEJ-UHFFFAOYSA-N

InChI=1S/C12H16O3/c1-4-12(2,3)15-14-11(13)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C12H16O3
Molecular Weight	208.2536
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 `Sat Dec 16 12:21:48 GMT 2023` Edited by `admin` on `Sat Dec 16 12:21:48 GMT 2023`
Record UNII	78VCF48V7F
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-Methylbutan-2-yl benzenecarboperoxoate

Systematic Name

English

Benzenecarboperoxoic acid, 1,1-dimethylpropyl ester

Systematic Name

English

Code System Code Type Description

FDA UNII

78VCF48V7F

Created by admin on Sat Dec 16 12:21:48 GMT 2023 , Edited by admin on Sat Dec 16 12:21:48 GMT 2023

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EPA CompTox

DTXSID2063503

Created by admin on Sat Dec 16 12:21:48 GMT 2023 , Edited by admin on Sat Dec 16 12:21:48 GMT 2023

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PUBCHEM

78267

Created by admin on Sat Dec 16 12:21:48 GMT 2023 , Edited by admin on Sat Dec 16 12:21:48 GMT 2023

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ECHA (EC/EINECS)

224-831-5

Created by admin on Sat Dec 16 12:21:48 GMT 2023 , Edited by admin on Sat Dec 16 12:21:48 GMT 2023

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CAS

4511-39-1

Created by admin on Sat Dec 16 12:21:48 GMT 2023 , Edited by admin on Sat Dec 16 12:21:48 GMT 2023

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