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Sodium hexadecyl sulfate

CAT: 0931-TYD-01271-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0931-TYD-01271-01Size:1 g
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CAS Number
1120-01-0
Bioactivity
Sodium hexadecyl sulfate is a reagent used in biochemical reactions.
Smiles
CCCCCCCCCCCCCCCCOS(=O)(O[Na])=O
Molecular Formula
C16H33NaO4S
Molecular Weight
344.49
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Cetyl sulfate sodium salt

See also: hexadecyl sulfate, (sodium salt) (annotation moved to).

CAS Number1120-01-0
PubChem CID23695542
IUPAC Namesodium hexadecyl sulfate
Molecular FormulaC16H33NaO4S
Molecular Weight344.5
Topological Polar Surface Area74.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count16
Heavy Atom Count22
Formal Charge0
Complexity302
SMILES
CCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]
InChI
InChI=1S/C16H34O4S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-21(17,18)19;/h2-16H2,1H3,(H,17,18,19);/q;+1/p-1
InChIKey
GGHPAKFFUZUEKL-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Cetyl sulfate sodium salt
CAS: 1120-01-0
CID: 23695542
Formula: C16H33NaO4S
MW: 344.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight344.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count16
Exact Mass344.19972499
Monoisotopic Mass344.19972499
Topological Polar Surface Area74.8 Ų
Heavy Atom Count22
Formal Charge0
Complexity302
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes