Docosanoic acid

Molecule structure of Behenic acid (CAS NO.112-85-6):

IUPAC Name: Docosanoic acid 
Molecular Weight: 340.58356 g/mol
Molecular Formula: C₂₂H₄₄O₂ 
Density: 0.881 g/cm³ 
Melting Point: 72-80 °C(lit.)
Boiling Point: 391.8 °C at 760 mmHg
Flash Point: 176.3 °C
Index of Refraction: 1.458
Molar Refractivity: 105.53 cm³
Molar Volume: 386.3 cm³
Polarizability: 41.83×10^-24 cm³
Surface Tension: 33.4 dyne/cm 
Enthalpy of Vaporization: 67.66 kJ/mol 
Vapour Pressure: 7.66E-07 mmHg at 25 °C 
Water Solubility: 0.016 mg/L
Storage Temp.: 2-8 °C
XLogP3: 9.6
H-Bond Donor:1
H-Bond Acceptor: 2
Rotatable Bond Count: 20
Exact Mass: 340.334131
MonoIsotopic Mass: 340.334131
Topological Polar Surface Area: 37.3
Heavy Atom Count: 24
Complexity: 250
Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)O
InChI: 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
EINECS: 204-010-8
Product Categories: Saturated Higher Fatty Acids;Alkylcarboxylic Acids;Biochemistry;Color Former & Related Compounds;Functional Materials;Higher Fatty Acids & Higher Alcohols;Monofunctional & alpha,omega-Bifunctional Alkanes;Monofunctional Alkanes;Sensitizer

 Behenic acid (CAS NO.112-85-6) is used in organic synthesis.

Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37/39-24/25 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection. 
S24/25:Avoid contact with skin and eyes.
Hazardous Substances Data 112-85-6(Hazardous Substances Data)
As a dietary oil, behenic acid is poorly absorbed. In spite of its low bioavailability compared with OLEIC ACID, behenic acid is a Cholesterol-raising fatty acid in humans.

 Behenic acid (CAS NO.112-85-6) is also named as 1-Docosanoic acid ; AI3-52709 ; Docosanoic acid ; Docosoic acid ; Glycon B-70 ; HSDB 5578 ; Hydrofol 2022-55 ; Hydrofol Acid 560 ; NSC 32364 ; UNII-H390488X0A ; n-Docosanoic acid . Behenic acid (CAS NO.112-85-6) is white to cream crystals or powder. It is stable and combustible. It is incompatible with bases, oxidizing agents, reducing agents.