1-Pentadecanesulfonic acid sodium salt
Product Information
Molecular Formula
C15H31NaO3S
Molecular Weight
314.46
Description
1-Pentadecanesulfonic acid sodium salt is a biochemical applied in the biomedical industry, mainly used in pharmaceutical preparation. It serves as a critical component in formulating medications that treat skin conditions like dermatitis and mild to severe forms of psoriasis.
Synonyms
1-PENTADECANESULFONIC ACID SODIUM SALT; PENTADECYL SODIUM SULFONATE; SODIUM 1-PENTADECANESULFONATE; pentadecanesulfonicacidsodiumsalt; sodium pentadecane-1-sulphonate; SODIUM1-PENTADECANESULPHONATE
IUPAC Name
sodiumpentadecane-1-sulfonate
SMILES
CCCCCCCCCCCCCCCS(=O)(=O)[O-].[Na+]
InChI
InChI=1S/C15H32O3S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(16,17)18/h2-15H2,1H3,(H,16,17,18)/q+1/p-1
InChI Key
PLQISZLZPSPBDP-UHFFFAOYSA-M
Appearance
White powder to crystal
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
14
Exact Mass
314.18916030 g/mol
Monoisotopic Mass
314.18916030 g/mol
Topological Polar Surface Area
65.6Ų
Heavy Atom Count
20
Formal Charge
0
Complexity
273
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
2
Compound Is Canonicalized
Yes
