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Details

Stereochemistry ACHIRAL
Molecular Formula C6H15NO3S
Molecular Weight 181.253
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(Butylamino)ethanesulfonic acid

SMILES

CCCCNCCS(O)(=O)=O

InChI

InChIKey=IPRSYPLQDZLFFB-UHFFFAOYSA-N
InChI=1S/C6H15NO3S/c1-2-3-4-7-5-6-11(8,9)10/h7H,2-6H2,1H3,(H,8,9,10)

HIDE SMILES / InChI

Molecular Formula C6H15NO3S
Molecular Weight 181.253
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 12:18:46 GMT 2023
Edited
by admin
on Sat Dec 16 12:18:46 GMT 2023
Record UNII
NQL65598HC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(Butylamino)ethanesulfonic acid
Systematic Name English
Ethanesulfonic acid, 2-(butylamino)-
Systematic Name English
Code System Code Type Description
PUBCHEM
87147
Created by admin on Sat Dec 16 12:18:46 GMT 2023 , Edited by admin on Sat Dec 16 12:18:46 GMT 2023
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CAS
17527-07-0
Created by admin on Sat Dec 16 12:18:46 GMT 2023 , Edited by admin on Sat Dec 16 12:18:46 GMT 2023
PRIMARY
ECHA (EC/EINECS)
241-524-1
Created by admin on Sat Dec 16 12:18:46 GMT 2023 , Edited by admin on Sat Dec 16 12:18:46 GMT 2023
PRIMARY
EPA CompTox
DTXSID20169961
Created by admin on Sat Dec 16 12:18:46 GMT 2023 , Edited by admin on Sat Dec 16 12:18:46 GMT 2023
PRIMARY
FDA UNII
NQL65598HC
Created by admin on Sat Dec 16 12:18:46 GMT 2023 , Edited by admin on Sat Dec 16 12:18:46 GMT 2023
PRIMARY