Ethyl isodehydracetate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H12O4
Molecular Weight	196.1999
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Ethyl isodehydracetate

Structure Search

SMILES

CCOC(=O)C1=C(C)OC(=O)C=C1C

InChI

InChIKey=FBPWNVQUVXSXKS-UHFFFAOYSA-N

InChI=1S/C10H12O4/c1-4-13-10(12)9-6(2)5-8(11)14-7(9)3/h5H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C10H12O4
Molecular Weight	196.1999
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 12:45:11 GMT 2023` Edited by `admin` on `Sat Dec 16 12:45:11 GMT 2023`
Record UNII	Z83SZN6YKC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Ethyl isodehydracetate

Common Name

English

AI3-05575

Code

English

Ethyl 4,6-dimethyl-2-oxo-2H-pyran-5-carboxylate

Systematic Name

English

2H-Pyran-5-carboxylic acid, 4,6-dimethyl-2-oxo-, ethyl ester

Systematic Name

English

Ethyl 2,4-dimethyl-6-oxopyran-3-carboxylate

Systematic Name

English

NSC-18911

Code

English

Code System Code Type Description

NSC

18911

Created by admin on Sat Dec 16 12:45:11 GMT 2023 , Edited by admin on Sat Dec 16 12:45:11 GMT 2023

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EPA CompTox

DTXSID80187489

Created by admin on Sat Dec 16 12:45:11 GMT 2023 , Edited by admin on Sat Dec 16 12:45:11 GMT 2023

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ECHA (EC/EINECS)

222-195-3

Created by admin on Sat Dec 16 12:45:11 GMT 2023 , Edited by admin on Sat Dec 16 12:45:11 GMT 2023

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CAS

3385-34-0

Created by admin on Sat Dec 16 12:45:11 GMT 2023 , Edited by admin on Sat Dec 16 12:45:11 GMT 2023

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PUBCHEM

76918

Created by admin on Sat Dec 16 12:45:11 GMT 2023 , Edited by admin on Sat Dec 16 12:45:11 GMT 2023

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FDA UNII

Z83SZN6YKC

Created by admin on Sat Dec 16 12:45:11 GMT 2023 , Edited by admin on Sat Dec 16 12:45:11 GMT 2023

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