DIMETHYL ITACONATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H10O4
Molecular Weight	158.1519
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DIMETHYL ITACONATE

Structure Search

SMILES

COC(=O)CC(=C)C(=O)OC

InChI

InChIKey=ZWWQRMFIZFPUAA-UHFFFAOYSA-N

InChI=1S/C7H10O4/c1-5(7(9)11-3)4-6(8)10-2/h1,4H2,2-3H3

HIDE SMILES / InChI

Molecular Formula	C7H10O4
Molecular Weight	158.1519
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 `Tue Apr 01 19:59:40 GMT 2025` Edited by `admin` on `Tue Apr 01 19:59:40 GMT 2025`
Record UNII	11JIB0YI93
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

DIMETHYL ITACONATE

Systematic Name

English

NSC-385

Preferred Name

English

NSC-9385

Code

English

BUTANEDIOIC ACID, 2-METHYLENE-, 1,4-DIMETHYL ESTER

Systematic Name

English

DIMETHYL-ITACONATE

Systematic Name

English

METHYL 4-METHOXY-2-METHYLENE-4-OXOBUTANOATE

Systematic Name

English

DIMETHYL 2-METHYLENESUCCINATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

69240

Created by admin on Tue Apr 01 19:59:40 GMT 2025 , Edited by admin on Tue Apr 01 19:59:40 GMT 2025

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NSC

385

Created by admin on Tue Apr 01 19:59:40 GMT 2025 , Edited by admin on Tue Apr 01 19:59:40 GMT 2025

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ECHA (EC/EINECS)

210-519-6

Created by admin on Tue Apr 01 19:59:40 GMT 2025 , Edited by admin on Tue Apr 01 19:59:40 GMT 2025

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EPA CompTox

DTXSID80210701

Created by admin on Tue Apr 01 19:59:40 GMT 2025 , Edited by admin on Tue Apr 01 19:59:40 GMT 2025

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FDA UNII

11JIB0YI93

Created by admin on Tue Apr 01 19:59:40 GMT 2025 , Edited by admin on Tue Apr 01 19:59:40 GMT 2025

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NSC

9385

Created by admin on Tue Apr 01 19:59:40 GMT 2025 , Edited by admin on Tue Apr 01 19:59:40 GMT 2025

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CAS

617-52-7

Created by admin on Tue Apr 01 19:59:40 GMT 2025 , Edited by admin on Tue Apr 01 19:59:40 GMT 2025

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