ETHYL 5-METHYL-3-OXOHEXANOATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H16O3
Molecular Weight	172.2215
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHYL 5-METHYL-3-OXOHEXANOATE

Structure Search

SMILES

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

InChI

InChIKey=FNVGQABNHXEIBU-UHFFFAOYSA-N

InChI=1S/C9H16O3/c1-4-12-9(11)6-8(10)5-7(2)3/h7H,4-6H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C9H16O3
Molecular Weight	172.2215
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 12:19:03 GMT 2023` Edited by `admin` on `Sat Dec 16 12:19:03 GMT 2023`
Record UNII	7PIJ0UO5N7
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ETHYL 5-METHYL-3-OXOHEXANOATE

Systematic Name

English

NSC-69069

Code

English

HEXANOIC ACID, 5-METHYL-3-OXO-, ETHYL ESTER

Common Name

English

5-METHYL-3-OXOHEXANOIC ACID ETHYL ESTER

Systematic Name

English

Code System Code Type Description

FDA UNII

7PIJ0UO5N7

Created by admin on Sat Dec 16 12:19:03 GMT 2023 , Edited by admin on Sat Dec 16 12:19:03 GMT 2023

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CAS

34036-16-3

Created by admin on Sat Dec 16 12:19:03 GMT 2023 , Edited by admin on Sat Dec 16 12:19:03 GMT 2023

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NSC

69069

Created by admin on Sat Dec 16 12:19:03 GMT 2023 , Edited by admin on Sat Dec 16 12:19:03 GMT 2023

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ECHA (EC/EINECS)

251-802-4

Created by admin on Sat Dec 16 12:19:03 GMT 2023 , Edited by admin on Sat Dec 16 12:19:03 GMT 2023

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EPA CompTox

DTXSID00187643

Created by admin on Sat Dec 16 12:19:03 GMT 2023 , Edited by admin on Sat Dec 16 12:19:03 GMT 2023

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PUBCHEM

96344

Created by admin on Sat Dec 16 12:19:03 GMT 2023 , Edited by admin on Sat Dec 16 12:19:03 GMT 2023

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