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CAS No.: | 26762-44-7 |
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Name: | 1-OCTADECANOL |
Molecular Structure: | |
Formula: | C18H38O |
Molecular Weight: | 270.49 |
Synonyms: | STEARYLIC ALCOHOL;N-OCTADECYL ALCOHOL;1-OCTADECANOL;ALCOHOL C18;Steary alcohol |
EINECS: | 204-017-6 |
Density: | 0.836 g/cm3 |
Melting Point: | 56-59oC(lit.) |
Boiling Point: | 331.6oC at 760 mmHg |
Flash Point: | 124.9oC |
Safety: | 24/25 |
PSA: | 20.23000 |
LogP: | 6.24020 |
The Octadecanol is an organic compound with the formula C18H38O. With the CAS registry number 26762-44-7, the IUPAC name of this chemical is octadecan-5-ol. When you are using it, avoid contact with skin and eyes.
Physical properties about Octadecanol are: (1)ACD/LogP: 8.13; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.13; (4)ACD/LogD (pH 7.4): 8.13; (5)ACD/BCF (pH 5.5): 889029.06; (6)ACD/BCF (pH 7.4): 889029.06; (7)ACD/KOC (pH 5.5): 630671.56; (8)ACD/KOC (pH 7.4): 630671.56; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 16; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.449; (14)Molar Refractivity: 86.93 cm3; (15)Molar Volume: 323.5 cm3; (16)Polarizability: 34.46×10-24cm3; (17)Surface Tension: 30.8 dyne/cm; (18)Density: 0.836 g/cm3; (19)Flash Point: 124.9 °C; (20)Enthalpy of Vaporization: 66.55 kJ/mol; (21)Boiling Point: 331.6 °C at 760 mmHg; (22)Vapour Pressure: 1.11E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: OC(CCCCCCCCCCCCC)CCCC
(2)InChI: InChI=1/C18H38O/c1-3-5-7-8-9-10-11-12-13-14-15-17-18(19)16-6-4-2/h18-19H,3-17H2,1-2H3
(3)InChIKey: QANCZOOABLPKBN-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C18H38O/c1-3-5-7-8-9-10-11-12-13-14-15-17-18(19)16-6-4-2/h18-19H,3-17H2,1-2H3
(5)Std. InChIKey: QANCZOOABLPKBN-UHFFFAOYSA-N