Docosanoic acid Structure

Docosanoic acid

Chemical Properties

Melting point 72-80 °C(lit.)
Boiling point 306°C 60mm
Density  d4100 0.8221
vapor pressure  0Pa at 25℃
refractive index  nD100 1.4270
Flash point 306°C/60mm
storage temp.  Sealed in dry,Room Temperature
solubility  chloroform: soluble50mg/mL, clear
form  Crystalline Powder
pka 4.78±0.10(Predicted)
color  White to slightly yellow
Odor faint odor
biological source synthetic
Water Solubility  Soluble in DMF (~3 mg/ml), hot methanol, water (0.15 mg/ml at 25°C), chloroform, and ethanol (2.18 mg/ml at 25°C).
Merck  14,1023
BRN  1792887
Henry's Law Constant 9.5×10-2 mol/(m3Pa) at 25℃, Abraham (2003)
Stability Stable. Combustible. Incompatible with bases, oxidizing agents, reducing agents.
Cosmetics Ingredients Functions SURFACTANT - CLEANSING
CLEANSING
SURFACTANT - EMULSIFYING
OPACIFYING
Cosmetic Ingredient Review (CIR) Docosanoic acid (112-85-6)
InChI 1S/C22H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h2-21H2,1H3,(H,23,24)
InChIKey UKMSUNONTOPOIO-UHFFFAOYSA-N
SMILES CCCCCCCCCCCCCCCCCCCCCC(O)=O
LogP 4.121-9.91 at 25℃
CAS DataBase Reference 112-85-6(CAS DataBase Reference)
FDA 21 CFR 357.210
EWG's Food Scores 1
FDA UNII H390488X0A
NIST Chemistry Reference Docosanoic acid(112-85-6)
EPA Substance Registry System Docosanoic acid (112-85-6)
UNSPSC Code 85151701
NACRES NA.24

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Risk Statements  36/37/38
Safety Statements  26-36/37/39-24/25
WGK Germany  -
TSCA  TSCA listed
HS Code  29159000
Storage Class 11 - Combustible Solids
Hazardous Substances Data 112-85-6(Hazardous Substances Data)
NFPA 704:
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