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3322-62-1

Basic Information
CAS No.: 3322-62-1
Name: OLEAMIDE
Article Data: 45
Molecular Structure:
Molecular Structure of 3322-62-1 (OLEAMIDE)
Formula: C18H35NO
Molecular Weight: 281.482
Synonyms: octadec-9-enamide;
Density: 0.879 g/cm3
Melting Point: 72-75 °C
Boiling Point: 433.3 °C at 760 mmHg
Flash Point: 215.9 °C
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Specification

The 9-Octadecenamide, with the CAS registry number 3322-62-1, has the systematic name of octadec-9-enamide. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of this chemical is C18H35NO.

The physical properties of 9-Octadecenamide are as following: (1)(1)ACD/LogP: 6.75; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.75; (4)ACD/LogD (pH 7.4): 6.75; (5)ACD/BCF (pH 5.5): 79298.3; (6)ACD/BCF (pH 7.4): 79298.38; (7)ACD/KOC (pH 5.5): 111808; (8)ACD/KOC (pH 7.4): 111808.13; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 15; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.468; (14)Molar Refractivity: 89.06 cm3; (15)Molar Volume: 320 cm3; (16)Polarizability: 35.3×10-24cm3; (17)Surface Tension: 33.4 dyne/cm; (18)Density: 0.879 g/cm3; (19)Flash Point: 215.9 °C; (20)Enthalpy of Vaporization: 68.93 kJ/mol; (21)Boiling Point: 433.3 °C at 760 mmHg; (22)Vapour Pressure: 1.03E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N)CCCCCCCC=CCCCCCCCC
(2)InChI: InChI=1/C18H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H2,19,20)
(3)InChIKey: FATBGEAMYMYZAF-UHFFFAOYAK