The 1-Pentadecanol, with the CAS registry number of 629-76-5, is also known as n-1-Pentadecanol and Neodol 5. It belongs to the product categories of 1-Alkanols; Biochemistry; Higher Fatty Acids & Higher Alcohols; Monofunctional & Alpha, Omega-Bifunctional Alkanes; Monofunctional Alkanes; Saturated Higher Alcohols. Its EINECS registry number is 211-107-9. This chemical's molecular formula is C₁₅H₃₂O and molecular weight is 228.41. What's more, its IUPAC name is Pentadecan-1-ol. This chemical is low toxicity. During using it, avoid contact with skin and eyes. In addition, it should be stored in dry, cool, airtight place and avoid contact with oxidant.

Physical properties about 1-Pentadecanol are: (1)ACD/LogP: 6.72; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.72; (4)ACD/LogD (pH 7.4): 6.72; (5)ACD/BCF (pH 5.5): 75378.14; (6)ACD/BCF (pH 7.4): 75378.14; (7)ACD/KOC (pH 5.5): 107823.26; (8)ACD/KOC (pH 7.4): 107823.26; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 14; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.446; (14)Molar Refractivity: 73.07 cm³; (15)Molar Volume: 273.6 cm³; (16)Polarizability: 28.96×10^-24 cm³; (17)Surface Tension: 30.9 dyne/cm; (18)Density: 0.834 g/cm³; (19)Flash Point: 130.1 °C; (20)Enthalpy of Vaporization: 62.46 kJ/mol; (21)Boiling Point: 298.5 °C at 760 mmHg; (22)Melting Point: 41-44 °C(lit. ); (23)Vapour Pressure: 0.000127 mmHg at 25°C.

Preparation: this chemical is prepared from N-Palmitoxy-2-pyridinethione at ambient temperature. The reaction needs reagent antimony Trisphenylsulphide and solvent Diethyl ether. The reaction time is 1 hour. The yield is about 75%.

Uses: (1) it is used as solvent or gas chromatography standard substance. (2) it is used to produce other chemicals. For example, it can react with 2, 5-Dioxo-2, 5-dihydro-furan-3-sulfonic acid to give 2-Sulfo-but-2-enedioic acid 4-pentadecyl ester. The condition of this reaction is reaction time of 1 hour at 70 °C. The yield is about 96%.

You can still convert the following datas into molecular structure:
(1) SMILES: OCCCCCCCCCCCCCCC
(2) InChI: InChI=1/C15H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h16H,2-15H2,1H3
(3) InChIKey: REIUXOLGHVXAEO-UHFFFAOYAZ