Nonaethylene glycol nonylphenyl ether

Base Information

• Chemical Name: Nonaethylene glycol nonylphenyl ether
• CAS No.: 14409-72-4
• Deprecated CAS: 41257-07-2
• Molecular Formula: C33H60O10
• Molecular Weight: 616.833
• Hs Code.: 2909499000
• European Community (EC) Number: 247-816-5,604-395-6
• ICSC Number: 1558
• NSC Number: 758941
• DSSTox Substance ID: DTXSID00858720
• Nikkaji Number: J9.826D
• Wikipedia: Nonoxynol-9
• Wikidata: Q420039
• NCI Thesaurus Code: C82312
• RXCUI: 53750
• Metabolomics Workbench ID: 43708
• ChEMBL ID: CHEMBL1410
• Mol file: 14409-72-4.mol

Synonyms:Advantage S;Advantage-S;Delfen Cream;Delfen Creams;Emulgen 911;Emulgin 913;Nonoxinol;Nonoxinols;Nonoxynol;Nonoxynol 9;Nonoxynol, 1(4)-Sulfate, Sodium Salt;Nonoxynol, 4-Sulfate, Ammonium Salt;Nonoxynol-9;Nonoxynols;Nonylphenoxypolyethoxyethanol;Nonylphenoxypolyethoxyethanols;Oval, Patentex;Patentex Oval

Chemical Property of Nonaethylene glycol nonylphenyl ether

Chemical Property:

• Boiling Point: 662.124 °C at 760 mmHg
• PKA: 14.36±0.10(Predicted)
• Flash Point: 354.24 °C
• PSA: 103.30000
• Density: 1.044 g/cm³
• LogP: 4.48360
• Storage Temp.: Refrigerator
• Solubility.: Chloroform(Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 35
• Exact Mass: 616.41864811
• Heavy Atom Count: 43
• Complexity: 520

Purity/Quality:

99% ^*data from raw suppliers

Nonoxynol 9 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOCCOCCOCCOCCOCCO
• Recent ClinicalTrials: Study of Contraceptive Efficacy & Safety of Phexxi? (Previously Known as Amphora) Gel Compared to Conceptrol Vaginal Gel
• Inhalation Risk: No indication can be given about the rate at which a harmful concentration of this substance in the air is reached on evaporation at 20 °C.
• Description: Nonoxynol-9 (N-9) is a typical surfactant used as a vaginal spermicide. Spermicides are locally acting non-hormonal contraceptives. When present in the vagina during intercourse, they immobilize/inactivate/damage and/or kill sperms without eliciting systemic effects. N-9 has been in use for more than 30 years as an over-the-counter (OTC) drug in creams, gels, foams and condom lubricants. It is the most commonly used spermicidal contraceptive in the UK and the USA. In several European countries, spermicides are no longer on the market.
• Uses: Nonoxynol 9 is a reagent used to prepare compounds that show spermacidal activity. It is also a polyoxyethylene surfactant that shows toxicity to certain wildlife. Ranges from 5-15 ethyleneoxy moiety.