O-DODECYLBENZENESULFONIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H30O3S
Molecular Weight	326.494
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of O-DODECYLBENZENESULFONIC ACID

Structure Search

SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(O)(=O)=O

InChI

InChIKey=WBIQQQGBSDOWNP-UHFFFAOYSA-N

InChI=1S/C18H30O3S/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21)

HIDE SMILES / InChI

Molecular Formula	C18H30O3S
Molecular Weight	326.494
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:45:32 GMT 2025` Edited by `admin` on `Mon Mar 31 21:45:32 GMT 2025`
Record UNII	QMO4A07H35
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BENZENESULFONIC ACID, 2-DODECYL-

Preferred Name

English

O-DODECYLBENZENESULFONIC ACID

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID10860152

Created by admin on Mon Mar 31 21:45:32 GMT 2025 , Edited by admin on Mon Mar 31 21:45:32 GMT 2025

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PUBCHEM

25457

Created by admin on Mon Mar 31 21:45:32 GMT 2025 , Edited by admin on Mon Mar 31 21:45:32 GMT 2025

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CHEBI

149774

Created by admin on Mon Mar 31 21:45:32 GMT 2025 , Edited by admin on Mon Mar 31 21:45:32 GMT 2025

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FDA UNII

QMO4A07H35

Created by admin on Mon Mar 31 21:45:32 GMT 2025 , Edited by admin on Mon Mar 31 21:45:32 GMT 2025

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CAS

47221-31-8

Created by admin on Mon Mar 31 21:45:32 GMT 2025 , Edited by admin on Mon Mar 31 21:45:32 GMT 2025

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