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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7NO4S
Molecular Weight 213.21
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Methyl-5-benzoxazolesulfonic acid

SMILES

CC1=NC2=C(O1)C=CC(=C2)S(O)(=O)=O

InChI

InChIKey=GXGKTKGTVRUVMR-UHFFFAOYSA-N
InChI=1S/C8H7NO4S/c1-5-9-7-4-6(14(10,11)12)2-3-8(7)13-5/h2-4H,1H3,(H,10,11,12)

HIDE SMILES / InChI

Molecular Formula C8H7NO4S
Molecular Weight 213.21
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 12:36:47 GMT 2023
Edited
by admin
on Sat Dec 16 12:36:47 GMT 2023
Record UNII
X7CFA33ARC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Methyl-5-benzoxazolesulfonic acid
Systematic Name English
5-Benzoxazolesulfonic acid, 2-methyl-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
229-824-0
Created by admin on Sat Dec 16 12:36:47 GMT 2023 , Edited by admin on Sat Dec 16 12:36:47 GMT 2023
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CAS
6764-43-8
Created by admin on Sat Dec 16 12:36:47 GMT 2023 , Edited by admin on Sat Dec 16 12:36:47 GMT 2023
PRIMARY
EPA CompTox
DTXSID4064470
Created by admin on Sat Dec 16 12:36:47 GMT 2023 , Edited by admin on Sat Dec 16 12:36:47 GMT 2023
PRIMARY
FDA UNII
X7CFA33ARC
Created by admin on Sat Dec 16 12:36:47 GMT 2023 , Edited by admin on Sat Dec 16 12:36:47 GMT 2023
PRIMARY
PUBCHEM
81236
Created by admin on Sat Dec 16 12:36:47 GMT 2023 , Edited by admin on Sat Dec 16 12:36:47 GMT 2023
PRIMARY