1,5-Diethyl 3-methylpentanedioate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H18O4
Molecular Weight	202.2475
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,5-Diethyl 3-methylpentanedioate

Structure Search

SMILES

CCOC(=O)CC(C)CC(=O)OCC

InChI

InChIKey=SEWQUYBTRMDUQS-UHFFFAOYSA-N

InChI=1S/C10H18O4/c1-4-13-9(11)6-8(3)7-10(12)14-5-2/h8H,4-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C10H18O4
Molecular Weight	202.2475
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 18:48:39 GMT 2025` Edited by `admin` on `Tue Apr 01 18:48:39 GMT 2025`
Record UNII	AA4HK37RUK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Pentanedioic acid, 3-methyl-, 1,5-diethyl ester

Preferred Name

English

1,5-Diethyl 3-methylpentanedioate

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

229-906-6

Created by admin on Tue Apr 01 18:48:39 GMT 2025 , Edited by admin on Tue Apr 01 18:48:39 GMT 2025

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EPA CompTox

DTXSID3064483

Created by admin on Tue Apr 01 18:48:39 GMT 2025 , Edited by admin on Tue Apr 01 18:48:39 GMT 2025

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PUBCHEM

81273

Created by admin on Tue Apr 01 18:48:39 GMT 2025 , Edited by admin on Tue Apr 01 18:48:39 GMT 2025

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CAS

6829-42-1

Created by admin on Tue Apr 01 18:48:39 GMT 2025 , Edited by admin on Tue Apr 01 18:48:39 GMT 2025

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FDA UNII

AA4HK37RUK

Created by admin on Tue Apr 01 18:48:39 GMT 2025 , Edited by admin on Tue Apr 01 18:48:39 GMT 2025

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