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Details

Stereochemistry ACHIRAL
Molecular Formula C7H5FO4S
Molecular Weight 204.176
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(FLUOROSULFONYL)BENZOIC ACID

SMILES

OC(=O)C1=CC=CC(=C1)S(F)(=O)=O

InChI

InChIKey=VWYMBWGOJRULOV-UHFFFAOYSA-N
InChI=1S/C7H5FO4S/c8-13(11,12)6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10)

HIDE SMILES / InChI

Molecular Formula C7H5FO4S
Molecular Weight 204.176
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 12:13:59 GMT 2023
Edited
by admin
on Sat Dec 16 12:13:59 GMT 2023
Record UNII
JHS963JL6K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(FLUOROSULFONYL)BENZOIC ACID
Systematic Name English
BENZOIC ACID, M-(FLUOROSULFONYL)-
Common Name English
3-FLUOROSULFONYLBENZOIC ACID
Common Name English
3-CARBOXYBENZENESULFONYL FLUORIDE
Common Name English
BENZOIC ACID, 3-(FLUOROSULFONYL)-
Systematic Name English
NSC-85599
Code English
Code System Code Type Description
NSC
85599
Created by admin on Sat Dec 16 12:13:59 GMT 2023 , Edited by admin on Sat Dec 16 12:13:59 GMT 2023
PRIMARY
ECHA (EC/EINECS)
207-232-3
Created by admin on Sat Dec 16 12:13:59 GMT 2023 , Edited by admin on Sat Dec 16 12:13:59 GMT 2023
PRIMARY
FDA UNII
JHS963JL6K
Created by admin on Sat Dec 16 12:13:59 GMT 2023 , Edited by admin on Sat Dec 16 12:13:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID20196499
Created by admin on Sat Dec 16 12:13:59 GMT 2023 , Edited by admin on Sat Dec 16 12:13:59 GMT 2023
PRIMARY
PUBCHEM
67992
Created by admin on Sat Dec 16 12:13:59 GMT 2023 , Edited by admin on Sat Dec 16 12:13:59 GMT 2023
PRIMARY
CAS
454-95-5
Created by admin on Sat Dec 16 12:13:59 GMT 2023 , Edited by admin on Sat Dec 16 12:13:59 GMT 2023
PRIMARY