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CIS-11-OCTADECENOIC ACID chemistry (11Z)-Octadec-11-enoic acid
1. Product advantages
♦ High purity, all above 98.5%, no impurities after dissolution
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Density 0.9± 0.1g /cm3
Boiling point 398.2±11.0 °C at 760 mmHg
Melting point 14-15ºC(lit.)
Molecular formula C18H34O2
Molecular weight 282.461
Flash point 295.0±14.4 °C
Accurate mass 282.255890
PSA 37.30000
LogP 7.70
Appearance character oil
Vapor pressure 0.0±2.0 mmHg at 25°C
Refractive index 1.467
Storage condition
Store sealed at -20°C in a ventilated, dry environment
stability
Use and storage according to specifications, will not occur decomposition, avoid contact with oxides
Molecular structure
1. Molar refractive index: 87.06
2, molar volume (cm3/mol) : 313.8
3. Isotropic volume (90.2K) : 757.2
4. Surface tension (dyne/cm) : 33.8
5. Polarization (10-24cm3) : 34.51
Computational chemistry
1. Reference value of hydrophobic parameter calculation (XlogP) : 6.5
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond receptors: 2
4. Number of rotatable bonds: 15
5. Number of tautomers:
6. Topological molecular polar surface area (TPSA) : 37.3
7. Number of heavy atoms: 20
8. Surface charge: 0
9. Complexity: 234
10. Number of isotope atoms: 0
11. Determine the number of atomic constitutive centers: 0
12. Number of uncertain atomic constitutive centers: 0
13. Determine the number of chemical bond structure centers: 1
14. Number of uncertain chemical bond structure centers: 0
15. Number of covalent bond units: 1
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