1,1-Digeranyloxynonane supplier

Name
1,1-Bis[(3,7-dimethyl-2,6-octadienyl)oxy]nonane
EINECS
CAS No. 67785-73-3
Density 0.875 g/cm³
Solubility
Melting Point
Formula C₂₉H₅₂O₂
Boiling Point 501.9 °C at 760 mmHg
Molecular Weight 432.722
Flash Point 97.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Nonane,1,1-bis[(3,7-dimethyl-2,6-octadienyl)oxy]- (9CI);1,1-bis{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}nonane;Nonane,1,1-bis[(3,7-dimethyl-2,6-octadien-1-yl)oxy]-;(2E)-1-[1-[(2E)-3,7-dimethylocta-2,6-dienoxy]nonoxy]-3,7-dimethylocta-2,;
PSA 18.46000
LogP 9.48170

1,1-Digeranyloxynonane Specification

The 1,1-Digeranyloxynonane, with the CAS registry number 67785-73-3, is also known as Nonane,1,1-bis[(3,7-dimethyl-2,6-octadien-1-yl)oxy]-. This chemical's molecular formula is C₂₉H₅₂O₂ and formula weight is 432.722. What's more, its IUPAC name is (2E)-1-[1-[(2E)-3,7-dimethylocta-2,6-dienoxy]nonoxy]-3,7-dimethylocta-2,6-diene.

Physical properties of 1,1-Digeranyloxynonane are: (1)ACD/LogP: 11.92; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 11.92; (4)ACD/BCF (pH 5.5): 1000000; (5)ACD/KOC (pH 5.5): 10000000; (6)#H bond acceptors: 2; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 19; (9)Polar Surface Area: 18.46 Å²; (10)Index of Refraction: 1.476; (11)Molar Refractivity: 139.45 cm³; (12)Molar Volume: 493.9 cm³; (13)Surface Tension: 30 dyne/cm; (14)Density: 0.875 g/cm³; (15)Flash Point: 97.6 °C; (16)Enthalpy of Vaporization: 74.16 kJ/mol; (17)Boiling Point: 501.9 °C at 760 mmHg; (18)Vapour Pressure: 1.04E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCCCCCC(OCC=C(C)CCC=C(C)C)OCC=C(C)CCC=C(C)C
(2)Isomeric SMILES: CCCCCCCCC(OC/C=C(/CCC=C(C)C)\C)OC/C=C(/CCC=C(C)C)\C
(3)InChI: InChI=1S/C29H52O2/c1-8-9-10-11-12-13-20-29(30-23-21-27(6)18-14-16-25(2)3)31-24-22-28(7)19-15-17-26(4)5/h16-17,21-22,29H,8-15,18-20,23-24H2,1-7H3/b27-21+,28-22+
(4)InChIKey: FOZNRVHWZWWCPV-GPAWKIAZSA-N

Product Name

1,1-Bis[(3,7-dimethyl-2,6-octadienyl)oxy]nonane

1,1-Digeranyloxynonane Specification

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