Tridecyl mercaptoacetate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H30O2S
Molecular Weight	274.463
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Tridecyl mercaptoacetate

Structure Search

SMILES

CCCCCCCCCCCCCOC(=O)CS

InChI

InChIKey=BANFORNDDZWGFX-UHFFFAOYSA-N

InChI=1S/C15H30O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-15(16)14-18/h18H,2-14H2,1H3

HIDE SMILES / InChI

Molecular Formula	C15H30O2S
Molecular Weight	274.463
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 `Wed Apr 02 17:32:50 GMT 2025` Edited by `admin` on `Wed Apr 02 17:32:50 GMT 2025`
Record UNII	W4KB8SL4N7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Tridecyl mercaptoacetate

Systematic Name

English

Acetic acid, 2-mercapto-, tridecyl ester

Preferred Name

English

Tridecyl 2-mercaptoacetate

Systematic Name

English

Code System Code Type Description

FDA UNII

W4KB8SL4N7

Created by admin on Wed Apr 02 17:32:50 GMT 2025 , Edited by admin on Wed Apr 02 17:32:50 GMT 2025

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ECHA (EC/EINECS)

256-739-6

Created by admin on Wed Apr 02 17:32:50 GMT 2025 , Edited by admin on Wed Apr 02 17:32:50 GMT 2025

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CAS

50727-78-1

Created by admin on Wed Apr 02 17:32:50 GMT 2025 , Edited by admin on Wed Apr 02 17:32:50 GMT 2025

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PUBCHEM

3016551

Created by admin on Wed Apr 02 17:32:50 GMT 2025 , Edited by admin on Wed Apr 02 17:32:50 GMT 2025

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EPA CompTox

DTXSID40198778

Created by admin on Wed Apr 02 17:32:50 GMT 2025 , Edited by admin on Wed Apr 02 17:32:50 GMT 2025

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