1,3-Dimethyl 2-(3-methylbutylidene)propanedioate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H16O4
Molecular Weight	200.2316
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,3-Dimethyl 2-(3-methylbutylidene)propanedioate

Structure Search

SMILES

COC(=O)C(=CCC(C)C)C(=O)OC

InChI

InChIKey=VMKTWDDHIHCHFX-UHFFFAOYSA-N

InChI=1S/C10H16O4/c1-7(2)5-6-8(9(11)13-3)10(12)14-4/h6-7H,5H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C10H16O4
Molecular Weight	200.2316
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 `Wed Apr 02 18:29:44 GMT 2025` Edited by `admin` on `Wed Apr 02 18:29:44 GMT 2025`
Record UNII	2MTU68RJ98
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-124621

Preferred Name

English

1,3-Dimethyl 2-(3-methylbutylidene)propanedioate

Systematic Name

English

(3-Methylbutylidene)malonic acid dimethyl ester

Systematic Name

English

Dimethyl isopentylidenemalonate

Systematic Name

English

2-(3-Methylbutylidene)malonic acid dimethyl ester

Systematic Name

English

Propanedioic acid, 2-(3-methylbutylidene)-, 1,3-dimethyl ester

Systematic Name

English

Dimethyl 2-(3-methylbutylidene)malonate

Systematic Name

English

Code System Code Type Description

CAS

53618-21-6

Created by admin on Wed Apr 02 18:29:44 GMT 2025 , Edited by admin on Wed Apr 02 18:29:44 GMT 2025

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EPA CompTox

DTXSID20298609

Created by admin on Wed Apr 02 18:29:44 GMT 2025 , Edited by admin on Wed Apr 02 18:29:44 GMT 2025

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PUBCHEM

276521

Created by admin on Wed Apr 02 18:29:44 GMT 2025 , Edited by admin on Wed Apr 02 18:29:44 GMT 2025

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FDA UNII

2MTU68RJ98

Created by admin on Wed Apr 02 18:29:44 GMT 2025 , Edited by admin on Wed Apr 02 18:29:44 GMT 2025

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