ETHYL 1,3-BENZODIOXOLE-5-PROPIONATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H14O4
Molecular Weight	222.2372
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHYL 1,3-BENZODIOXOLE-5-PROPIONATE

Structure Search

SMILES

CCOC(=O)CCC1=CC2=C(OCO2)C=C1

InChI

InChIKey=SHFDGDJEJOHKSV-UHFFFAOYSA-N

InChI=1S/C12H14O4/c1-2-14-12(13)6-4-9-3-5-10-11(7-9)16-8-15-10/h3,5,7H,2,4,6,8H2,1H3

HIDE SMILES / InChI

Molecular Formula	C12H14O4
Molecular Weight	222.2372
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 12:27:29 GMT 2023` Edited by `admin` on `Sat Dec 16 12:27:29 GMT 2023`
Record UNII	R5N78BMB7D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETHYL 1,3-BENZODIOXOLE-5-PROPIONATE

Systematic Name

English

1,3-BENZODIOXOLE-5-PROPANOIC ACID, ETHYL ESTER

Systematic Name

English

NSC-159431

Code

English

3-(BENZODIOXOL-5-YL)PROPIONIC ACID ETHYL ESTER

Common Name

English

ETHYL 3-(3,4-METHYLENEDIOXYPHENYL)PROPIONATE

Systematic Name

English

3-BENZO(1,3)DIOXOL-5-YL-PROPIONIC ACID ETHYL ESTER

Common Name

English

Code System Code Type Description

ECHA (EC/EINECS)

230-418-0

Created by admin on Sat Dec 16 12:27:29 GMT 2023 , Edited by admin on Sat Dec 16 12:27:29 GMT 2023

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FDA UNII

R5N78BMB7D

Created by admin on Sat Dec 16 12:27:29 GMT 2023 , Edited by admin on Sat Dec 16 12:27:29 GMT 2023

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PUBCHEM

81545

Created by admin on Sat Dec 16 12:27:29 GMT 2023 , Edited by admin on Sat Dec 16 12:27:29 GMT 2023

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CAS

7116-48-5

Created by admin on Sat Dec 16 12:27:29 GMT 2023 , Edited by admin on Sat Dec 16 12:27:29 GMT 2023

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EPA CompTox

DTXSID80221352

Created by admin on Sat Dec 16 12:27:29 GMT 2023 , Edited by admin on Sat Dec 16 12:27:29 GMT 2023

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NSC

159431

Created by admin on Sat Dec 16 12:27:29 GMT 2023 , Edited by admin on Sat Dec 16 12:27:29 GMT 2023

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