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CAS No.: | 35857-62-6 |
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Name: | trans-9-Tricosene |
Article Data: | 10 |
Molecular Structure: | |
Formula: | C23H46 |
Molecular Weight: | 322.618 |
Synonyms: | 9-Tricosene,(E)-;(E)-9-Tricosene;trans-9-Tricosene;(E)-tricos-9-ene;(9E)-tricos-9-ene; |
Density: | 0.802 g/cm3 |
Boiling Point: | 399.4 °C at 760 mmHg |
Flash Point: | 208.9 °C |
PSA: | 0.00000 |
LogP: | 8.99430 |
The 9-Tricosene, (9E)-, with the CAS registry number 35857-62-6, has the systematic name of (9E)-tricos-9-ene. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C23H46.
The characteristics of 9-Tricosene, (9E)- are as followings: (1)ACD/LogP: 12.46; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 12.46; (4)ACD/LogD (pH 7.4): 12.46; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 19; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.453; (14)Molar Refractivity: 108.66 cm3; (15)Molar Volume: 401.8 cm3; (16)Polarizability: 43.07×10-24cm3; (17)Surface Tension: 29.2 dyne/cm; (18)Density: 0.802 g/cm3; (19)Flash Point: 208.9 °C; (20)Enthalpy of Vaporization: 62.48 kJ/mol; (21)Boiling Point: 399.4 °C at 760 mmHg; (22)Vapour Pressure: 3.16E-06 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: C(=C/CCCCCCCCCCCCC)\CCCCCCCC
(2)InChI: InChI=1/C23H46/c1-3-5-7-9-11-13-15-17-19-21-23-22-20-18-16-14-12-10-8-6-4-2/h17,19H,3-16,18,20-23H2,1-2H3/b19-17+
(3)InChIKey: IGOWHGRNPLFNDJ-HTXNQAPBBD