1-(3-SULFONATOPROPYL)-2-VINYLPYRIDINIUM

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H13NO3S
Molecular Weight	227.28
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(3-SULFONATOPROPYL)-2-VINYLPYRIDINIUM

Structure Search

SMILES

[O-]S(=O)(=O)CCC[N+]1=CC=CC=C1C=C

InChI

InChIKey=DNHDSWZXBHTLDP-UHFFFAOYSA-N

InChI=1S/C10H13NO3S/c1-2-10-6-3-4-7-11(10)8-5-9-15(12,13)14/h2-4,6-7H,1,5,8-9H2

HIDE SMILES / InChI

Molecular Formula	C10H13NO3S
Molecular Weight	227.28
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 19:31:48 GMT 2025` Edited by `admin` on `Tue Apr 01 19:31:48 GMT 2025`
Record UNII	NH2H8VRY6L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-(3-SULFONATOPROPYL)-2-VINYLPYRIDINIUM

Systematic Name

English

3-(2-VINYLPYRIDINIUM-1-YL)PROPANE-1-SULFONATE

Preferred Name

English

Code System Code Type Description

EPA CompTox

DTXSID60216327

Created by admin on Tue Apr 01 19:31:48 GMT 2025 , Edited by admin on Tue Apr 01 19:31:48 GMT 2025

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PUBCHEM

81089

Created by admin on Tue Apr 01 19:31:48 GMT 2025 , Edited by admin on Tue Apr 01 19:31:48 GMT 2025

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ECHA (EC/EINECS)

229-565-3

Created by admin on Tue Apr 01 19:31:48 GMT 2025 , Edited by admin on Tue Apr 01 19:31:48 GMT 2025

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FDA UNII

NH2H8VRY6L

Created by admin on Tue Apr 01 19:31:48 GMT 2025 , Edited by admin on Tue Apr 01 19:31:48 GMT 2025

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CAS

6613-64-5

Created by admin on Tue Apr 01 19:31:48 GMT 2025 , Edited by admin on Tue Apr 01 19:31:48 GMT 2025

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