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Details

Stereochemistry ACHIRAL
Molecular Formula C8H10NO3S.Na
Molecular Weight 223.225
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 5-AMINO-O-XYLENE-3-SULFONATE

SMILES

[Na+].CC1=CC(N)=CC(=C1C)S([O-])(=O)=O

InChI

InChIKey=RZPNIEXEVYHEQR-UHFFFAOYSA-M
InChI=1S/C8H11NO3S.Na/c1-5-3-7(9)4-8(6(5)2)13(10,11)12;/h3-4H,9H2,1-2H3,(H,10,11,12);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C8H10NO3S
Molecular Weight 200.235
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:21:18 GMT 2023
Edited
by admin
on Sat Dec 16 12:21:18 GMT 2023
Record UNII
IE9ZLG2R42
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM 5-AMINO-O-XYLENE-3-SULFONATE
Common Name English
BENZENESULFONIC ACID, 5-AMINO-2,3-DIMETHYL-, MONOSODIUM SALT
Systematic Name English
Code System Code Type Description
CAS
94159-54-3
Created by admin on Sat Dec 16 12:21:18 GMT 2023 , Edited by admin on Sat Dec 16 12:21:18 GMT 2023
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ECHA (EC/EINECS)
303-234-4
Created by admin on Sat Dec 16 12:21:18 GMT 2023 , Edited by admin on Sat Dec 16 12:21:18 GMT 2023
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EPA CompTox
DTXSID90240877
Created by admin on Sat Dec 16 12:21:18 GMT 2023 , Edited by admin on Sat Dec 16 12:21:18 GMT 2023
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FDA UNII
IE9ZLG2R42
Created by admin on Sat Dec 16 12:21:18 GMT 2023 , Edited by admin on Sat Dec 16 12:21:18 GMT 2023
PRIMARY
PUBCHEM
44146611
Created by admin on Sat Dec 16 12:21:18 GMT 2023 , Edited by admin on Sat Dec 16 12:21:18 GMT 2023
PRIMARY