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Sodium laureth sulfate

CAT: 0127-BUP18587Size: 10 gDry Ice: NoHazardous: No
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CAT#:0127-BUP18587Size:10 g
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CAS Number
9004-82-4
Synonyms
Sodium lauryl polyoxyethylene ether sulfate
Purity
=70%
Smiles
CCCCCCCCCCCCOCCOS([O-])(=O)=O.[Na+]

Chemical Information

Sodium laureth sulfate

Sodium laureth sulfate is a detergent and surfactant found in many personal care products (soaps, shampoos, toothpaste etc.). It is an inexpensive and very effective foaming agent made by mixing sulfuric acid, monododecyl ester, and sodium salt. Sodium laureth sulfate may cause eye or skin irritation. (L1899)

CAS Number9004-82-4
PubChem CID23665884
IUPAC Namesodium 2-dodecoxyethyl sulfate
Molecular FormulaC14H29NaO5S
Molecular Weight332.43
Topological Polar Surface Area84
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count15
Heavy Atom Count21
Formal Charge0
Complexity290
SMILES
CCCCCCCCCCCCOCCOS(=O)(=O)[O-].[Na+]
InChI
InChI=1S/C14H30O5S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-14-19-20(15,16)17;/h2-14H2,1H3,(H,15,16,17);/q;+1/p-1
InChIKey
ASEFUFIKYOCPIJ-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Sodium laureth sulfate
CAS: 9004-82-4
CID: 23665884
Formula: C14H29NaO5S
MW: 332.43
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight332.43
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count15
Exact Mass332.16333948
Monoisotopic Mass332.16333948
Topological Polar Surface Area84 Ų
Heavy Atom Count21
Formal Charge0
Complexity290
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