Dimethyl 4,4'-thiobisbutyrate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H18O4S
Molecular Weight	234.313
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Dimethyl 4,4'-thiobisbutyrate

Structure Search

SMILES

COC(=O)CCCSCCCC(=O)OC

InChI

InChIKey=UWLNIOIUTIBVPI-UHFFFAOYSA-N

InChI=1S/C10H18O4S/c1-13-9(11)5-3-7-15-8-4-6-10(12)14-2/h3-8H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C10H18O4S
Molecular Weight	234.313
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 19:15:27 GMT 2025` Edited by `admin` on `Tue Apr 01 19:15:27 GMT 2025`
Record UNII	Z7TJ6XRL74
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Dimethyl 4,4'-thiobisbutyrate

Systematic Name

English

Butanoic acid, 4,4?-thiobis-, dimethyl ester

Preferred Name

English

Code System Code Type Description

FDA UNII

Z7TJ6XRL74

Created by admin on Tue Apr 01 19:15:27 GMT 2025 , Edited by admin on Tue Apr 01 19:15:27 GMT 2025

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EPA CompTox

DTXSID60198412

Created by admin on Tue Apr 01 19:15:27 GMT 2025 , Edited by admin on Tue Apr 01 19:15:27 GMT 2025

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ECHA (EC/EINECS)

256-553-5

Created by admin on Tue Apr 01 19:15:27 GMT 2025 , Edited by admin on Tue Apr 01 19:15:27 GMT 2025

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CAS

50354-51-3

Created by admin on Tue Apr 01 19:15:27 GMT 2025 , Edited by admin on Tue Apr 01 19:15:27 GMT 2025

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PUBCHEM

6452199

Created by admin on Tue Apr 01 19:15:27 GMT 2025 , Edited by admin on Tue Apr 01 19:15:27 GMT 2025

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