MESITYL OXIDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H10O
Molecular Weight	98.143
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of MESITYL OXIDE

Structure Search

SMILES

CC(C)=CC(C)=O

InChI

InChIKey=SHOJXDKTYKFBRD-UHFFFAOYSA-N

InChI=1S/C6H10O/c1-5(2)4-6(3)7/h4H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C6H10O
Molecular Weight	98.143
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 18:44:41 UTC 2023` Edited by `admin` on `Fri Dec 15 18:44:41 UTC 2023`
Record UNII	77LAC84669
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MESITYL OXIDE

Systematic Name

English

CILASTATIN SODIUM IMPURITY D [EP IMPURITY]

Common Name

English

MESITYL OXIDE [MI]

Common Name

English

TEICOPLANIN IMPURITY A [EP IMPURITY]

Common Name

English

NSC-38717

Code

English

4-METHYL-3-PENTENE-2-ONE [FHFI]

Common Name

English

4-METHYL-3-PENTEN-2-ONE

Systematic Name

English

2-METHYL-2-PENTEN-4-ONE

Systematic Name

English

ISOBUTENYL METHYL KETONE

Systematic Name

English

3-PENTEN-2-ONE, 4-METHYL-

Systematic Name

English

METHYL 2,2-DIMETHYLVINYL KETONE

Systematic Name

English

MESITYL OXIDE [HSDB]

Common Name

English

METHYL ISOBUTENYL KETONE

Systematic Name

English

4-METHYL-3-PENTENE-2-ONE

Systematic Name

English

FEMA NO. 3368

Code

English

2,2-DIMETHYLVINYL METHYL KETONE

Systematic Name

English

ISOPROPYLIDENEACETONE

Systematic Name

English

4-METHYLPENT-3-EN-2-ONE

Systematic Name

English

OSSIDO DI MESITILE

Common Name

English

2-METHYL-4-OXO-2-PENTENE

Systematic Name

English

METHYL 2-METHYL-1-PROPENYL KETONE

Systematic Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

52401

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

JECFA EVALUATION

4-METHYL-3-PENTEN-2-ONE

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

Code System Code Type Description

ECHA (EC/EINECS)

205-502-5

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

PRIMARY

EPA CompTox

DTXSID1029170

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

PRIMARY

PUBCHEM

8858

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

PRIMARY

NSC

38717

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

PRIMARY

CAS

141-79-7

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

PRIMARY

MESH

C008374

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

PRIMARY

MERCK INDEX

m7248

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

PRIMARY

Merck Index

HSDB

1195

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

PRIMARY

FDA UNII

77LAC84669

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

PRIMARY

JECFA MONOGRAPH

1063

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

PRIMARY

WIKIPEDIA

MESITYL OXIDE

Created by admin on Fri Dec 15 18:44:41 UTC 2023 , Edited by admin on Fri Dec 15 18:44:41 UTC 2023

PRIMARY

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