n-Docosanol Structure

n-Docosanol

Chemical Properties

Melting point 65-72 °C(lit.)
Boiling point 180 °C0.22 mm Hg(lit.)
Density  d75 0.8063 g/ml; d85 0.7986 g/ml; d95 0.7911 g/ml
vapor pressure  0Pa at 25℃
refractive index  n75 1.4360
storage temp.  Store below +30°C.
solubility  Chloroform (Slightly), Ethyl Acetate (Slightly)
pka 15.20±0.10(Predicted)
form  Pellets or Tablets
color  White
Viscosity 9.7mm2/s
Water Solubility  Insoluble
Merck  13,3433
BRN  1770470
Stability Stable. Combustible. Incompatible with strong oxidizing agents.
Cosmetics Ingredients Functions SKIN CONDITIONING - EMOLLIENT
BINDING
VISCOSITY CONTROLLING
EMULSION STABILISING
Cosmetic Ingredient Review (CIR) n-Docosanol (661-19-8)
InChI 1S/C22H46O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h23H,2-22H2,1H3
InChIKey NOPFSRXAKWQILS-UHFFFAOYSA-N
SMILES CCCCCCCCCCCCCCCCCCCCCCO
LogP 8.3 at 20℃
CAS DataBase Reference 661-19-8(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII 9G1OE216XY
NIST Chemistry Reference 1-Docosanol(661-19-8)
EPA Substance Registry System 1-Docosanol (661-19-8)
UNSPSC Code 41116107
NACRES NA.24

Safety

Symbol(GHS) GHS hazard pictogramsGHS hazard pictograms
Signal wordWarning
Hazard statements H410-H319
Precautionary statements P273-P391-P501-P264-P280-P305+P351+P338-P337+P313P
Safety Statements  24/25
WGK Germany  -
RTECS  JR1315000
TSCA  TSCA listed
HS Code  29051900
Storage Class 11 - Combustible Solids
Hazardous Substances Data 661-19-8(Hazardous Substances Data)
Toxicity LD50 intraperitoneal in mouse: > 800mg/kg
NFPA 704:
1
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