U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C10H15NO3S
Molecular Weight 229.296
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-DIETHYLSULPHANILIC ACID

SMILES

CCN(CC)C1=CC=C(C=C1)S(O)(=O)=O

InChI

InChIKey=IVZFUJYJXUATPL-UHFFFAOYSA-N
InChI=1S/C10H15NO3S/c1-3-11(4-2)9-5-7-10(8-6-9)15(12,13)14/h5-8H,3-4H2,1-2H3,(H,12,13,14)

HIDE SMILES / InChI

Molecular Formula C10H15NO3S
Molecular Weight 229.296
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 12:32:44 GMT 2023
Edited
by admin
on Sat Dec 16 12:32:44 GMT 2023
Record UNII
67VM6KQG3T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N-DIETHYLSULPHANILIC ACID
Systematic Name English
P-(DIETHYLAMINO)BENZENESULFONIC ACID
Common Name English
BENZENESULFONIC ACID, 4-(DIETHYLAMINO)-
Systematic Name English
P-DIETHYLANILINESULFONIC ACID
Common Name English
4-(DIETHYLAMINO)BENZENESULFONIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
118833
Created by admin on Sat Dec 16 12:32:44 GMT 2023 , Edited by admin on Sat Dec 16 12:32:44 GMT 2023
PRIMARY
ECHA (EC/EINECS)
252-588-5
Created by admin on Sat Dec 16 12:32:44 GMT 2023 , Edited by admin on Sat Dec 16 12:32:44 GMT 2023
PRIMARY
FDA UNII
67VM6KQG3T
Created by admin on Sat Dec 16 12:32:44 GMT 2023 , Edited by admin on Sat Dec 16 12:32:44 GMT 2023
PRIMARY
CAS
35478-73-0
Created by admin on Sat Dec 16 12:32:44 GMT 2023 , Edited by admin on Sat Dec 16 12:32:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID30188986
Created by admin on Sat Dec 16 12:32:44 GMT 2023 , Edited by admin on Sat Dec 16 12:32:44 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT