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Details

Stereochemistry ACHIRAL
Molecular Formula C7H6BrO3S.Na
Molecular Weight 273.08
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-SODIOSULFOBENZYL BROMIDE

SMILES

[Na+].[O-]S(=O)(=O)C1=CC=C(CBr)C=C1

InChI

InChIKey=VUIRTEIRZXTTPR-UHFFFAOYSA-M
InChI=1S/C7H7BrO3S.Na/c8-5-6-1-3-7(4-2-6)12(9,10)11;/h1-4H,5H2,(H,9,10,11);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H6BrO3S
Molecular Weight 250.09
Charge -1
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 12:19:40 GMT 2023
Edited
by admin
on Sat Dec 16 12:19:40 GMT 2023
Record UNII
5ET22D4HT7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-SODIOSULFOBENZYL BROMIDE
Systematic Name English
NSC-370338
Code English
BENZENESULFONIC ACID, 4-(BROMOMETHYL)-, SODIUM SALT
Common Name English
Code System Code Type Description
FDA UNII
5ET22D4HT7
Created by admin on Sat Dec 16 12:19:40 GMT 2023 , Edited by admin on Sat Dec 16 12:19:40 GMT 2023
PRIMARY
ECHA (EC/EINECS)
250-898-5
Created by admin on Sat Dec 16 12:19:40 GMT 2023 , Edited by admin on Sat Dec 16 12:19:40 GMT 2023
PRIMARY
NSC
370338
Created by admin on Sat Dec 16 12:19:40 GMT 2023 , Edited by admin on Sat Dec 16 12:19:40 GMT 2023
PRIMARY
PUBCHEM
23688951
Created by admin on Sat Dec 16 12:19:40 GMT 2023 , Edited by admin on Sat Dec 16 12:19:40 GMT 2023
PRIMARY
EPA CompTox
DTXSID3067655
Created by admin on Sat Dec 16 12:19:40 GMT 2023 , Edited by admin on Sat Dec 16 12:19:40 GMT 2023
PRIMARY
CAS
32014-22-5
Created by admin on Sat Dec 16 12:19:40 GMT 2023 , Edited by admin on Sat Dec 16 12:19:40 GMT 2023
PRIMARY