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26762-44-7

Basic Information
CAS No.: 26762-44-7
Name: 1-OCTADECANOL
Molecular Structure:
Molecular Structure of 26762-44-7 (1-OCTADECANOL)
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
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  • 1-Octadecanol CAS No.26762-44-7

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Specification

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