1,1'-SULPHINYLBISHEPTANE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H30OS
Molecular Weight	246.452
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,1'-SULPHINYLBISHEPTANE

Structure Search

SMILES

CCCCCCC[S+]([O-])CCCCCCC

InChI

InChIKey=UVMACQYJONOGQU-UHFFFAOYSA-N

InChI=1S/C14H30OS/c1-3-5-7-9-11-13-16(15)14-12-10-8-6-4-2/h3-14H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C14H30OS
Molecular Weight	246.452
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 12:31:32 GMT 2023` Edited by `admin` on `Sat Dec 16 12:31:32 GMT 2023`
Record UNII	4VHA74FZP4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,1'-SULPHINYLBISHEPTANE

Systematic Name

English

Heptyl sulfoxide

Systematic Name

English

Diheptyl sulfoxide

Systematic Name

English

NSC-400539

Code

English

Heptane, 1,1′-sulfinylbis-

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

246-886-4

Created by admin on Sat Dec 16 12:31:32 GMT 2023 , Edited by admin on Sat Dec 16 12:31:32 GMT 2023

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NSC

400539

Created by admin on Sat Dec 16 12:31:32 GMT 2023 , Edited by admin on Sat Dec 16 12:31:32 GMT 2023

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PUBCHEM

91426

Created by admin on Sat Dec 16 12:31:32 GMT 2023 , Edited by admin on Sat Dec 16 12:31:32 GMT 2023

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EPA CompTox

DTXSID30180001

Created by admin on Sat Dec 16 12:31:32 GMT 2023 , Edited by admin on Sat Dec 16 12:31:32 GMT 2023

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FDA UNII

4VHA74FZP4

Created by admin on Sat Dec 16 12:31:32 GMT 2023 , Edited by admin on Sat Dec 16 12:31:32 GMT 2023

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CAS

25355-20-8

Created by admin on Sat Dec 16 12:31:32 GMT 2023 , Edited by admin on Sat Dec 16 12:31:32 GMT 2023

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