Tridecan-1-yl benzenesulfonate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H32O3S
Molecular Weight	340.521
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Tridecan-1-yl benzenesulfonate

Structure Search

SMILES

CCCCCCCCCCCCCOS(=O)(=O)C1=CC=CC=C1

InChI

InChIKey=KRTNITDCKAVIFI-UHFFFAOYSA-N

InChI=1S/C19H32O3S/c1-2-3-4-5-6-7-8-9-10-11-15-18-22-23(20,21)19-16-13-12-14-17-19/h12-14,16-17H,2-11,15,18H2,1H3

HIDE SMILES / InChI

Molecular Formula	C19H32O3S
Molecular Weight	340.521
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 `Fri Dec 15 15:26:22 GMT 2023` Edited by `admin` on `Fri Dec 15 15:26:22 GMT 2023`
Record UNII	36AUM5MX2P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Tridecan-1-yl benzenesulfonate

Systematic Name

English

1-Tridecanol, 1-benzenesulfonate

Systematic Name

English

1-Tridecanol, benzenesulfonate

Systematic Name

English

n-Tridecyl benzenesulfonate

Common Name

English

Tridecan-1-yl benzenesulphonate

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

247-016-6

Created by admin on Fri Dec 15 15:26:22 GMT 2023 , Edited by admin on Fri Dec 15 15:26:22 GMT 2023

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CAS

25474-61-7

Created by admin on Fri Dec 15 15:26:22 GMT 2023 , Edited by admin on Fri Dec 15 15:26:22 GMT 2023

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EPA CompTox

DTXSID40866889

Created by admin on Fri Dec 15 15:26:22 GMT 2023 , Edited by admin on Fri Dec 15 15:26:22 GMT 2023

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PUBCHEM

117520

Created by admin on Fri Dec 15 15:26:22 GMT 2023 , Edited by admin on Fri Dec 15 15:26:22 GMT 2023

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FDA UNII

36AUM5MX2P

Created by admin on Fri Dec 15 15:26:22 GMT 2023 , Edited by admin on Fri Dec 15 15:26:22 GMT 2023

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