Isopropyl 2-(thien-3-yl)acetate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H12O2S
Molecular Weight	184.255
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Isopropyl 2-(thien-3-yl)acetate

Structure Search

SMILES

CC(C)OC(=O)CC1=CSC=C1

InChI

InChIKey=UHMOHYVZZQBQIB-UHFFFAOYSA-N

InChI=1S/C9H12O2S/c1-7(2)11-9(10)5-8-3-4-12-6-8/h3-4,6-7H,5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C9H12O2S
Molecular Weight	184.255
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 19:49:56 GMT 2023` Edited by `admin` on `Sat Dec 16 19:49:56 GMT 2023`
Record UNII	ZQ2HHK6TU2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Isopropyl 2-(thien-3-yl)acetate

Systematic Name

English

1-Methylethyl 3-thiopheneacetate

Systematic Name

English

3-Thiopheneacetic acid, 1-methylethyl ester

Systematic Name

English

Code System Code Type Description

CAS

53064-74-7

Created by admin on Sat Dec 16 19:49:56 GMT 2023 , Edited by admin on Sat Dec 16 19:49:56 GMT 2023

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FDA UNII

ZQ2HHK6TU2

Created by admin on Sat Dec 16 19:49:56 GMT 2023 , Edited by admin on Sat Dec 16 19:49:56 GMT 2023

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PUBCHEM

104400

Created by admin on Sat Dec 16 19:49:56 GMT 2023 , Edited by admin on Sat Dec 16 19:49:56 GMT 2023

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EPA CompTox

DTXSID10201127

Created by admin on Sat Dec 16 19:49:56 GMT 2023 , Edited by admin on Sat Dec 16 19:49:56 GMT 2023

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ECHA (EC/EINECS)

258-338-1

Created by admin on Sat Dec 16 19:49:56 GMT 2023 , Edited by admin on Sat Dec 16 19:49:56 GMT 2023

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