Structure

InChI Key UDIPTWFVPPPURJ-UHFFFAOYSA-M
Smiles [Na+].[O-]S(=O)(=O)NC1CCCCC1
InChI
InChI=1/C6H13NO3S.Na/c8-11(9,10)7-6-4-2-1-3-5-6;/h6-7H,1-5H2,(H,8,9,10);/q;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H12NNaO3S
Molecular Weight 201.04
AlogP -2.63
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 69.23
Heavy Atoms 12.0

Cross References

Resources Reference
CAS NUMBER 139-05-9
NORMAN SUSDAT
FDA SRS 1I6F42RME1