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94088-08-1

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Basic Information
CAS No.: 94088-08-1
Name: 1-ethoxy-1,3-dimethoxynonane
Molecular Structure:
Molecular Structure of 94088-08-1 (1-ethoxy-1,3-dimethoxynonane)
Formula: C13H28O3
Molecular Weight: 232.35962
Synonyms: 1-Ethoxy-1,3-dimethoxynonane;
EINECS: 302-005-6
Density: 0.883 g/cm3
Boiling Point: 282.2 °C at 760 mmHg
Flash Point: 105 °C
PSA: 27.69000
LogP: 3.37090
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Specification

The 1-Ethoxy-1,3-dimethoxy-nonane is an organic compound with the formula C13H28O3. With the CAS registry number 94088-08-1, the IUPAC name of this chemical is 1-ethoxy-1,3-dimethoxynonane.

Physical properties about 1-Ethoxy-1,3-dimethoxy-nonane are: (1)ACD/LogP: 3.85; (2)ACD/LogD (pH 5.5): 3.85; (3)ACD/LogD (pH 7.4): 3.85; (4)ACD/BCF (pH 5.5): 492.73; (5)ACD/BCF (pH 7.4): 492.73; (6)ACD/KOC (pH 5.5): 2944.24; (7)ACD/KOC (pH 7.4): 2944.24; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 11; (10)Polar Surface Area: 27.69 Å2; (11)Index of Refraction: 1.426; (12)Molar Refractivity: 67.42 cm3; (13)Molar Volume: 262.9 cm3; (14)Polarizability: 26.73×10-24cm3; (15)Surface Tension: 27.6 dyne/cm; (16)Density: 0.883 g/cm3; (17)Flash Point: 105 °C; (18)Enthalpy of Vaporization: 50.01 kJ/mol; (19)Boiling Point: 282.2 °C at 760 mmHg; (20)Vapour Pressure: 0.00581 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(C(CC(OC)OCC)CCCCCC)C
(2)InChI: InChI=1/C13H28O3/c1-5-7-8-9-10-12(14-3)11-13(15-4)16-6-2/h12-13H,5-11H2,1-4H3
(3)InChIKey: JBLJTYZSYJSTNX-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C13H28O3/c1-5-7-8-9-10-12(14-3)11-13(15-4)16-6-2/h12-13H,5-11H2,1-4H3
(5)Std. InChIKey: JBLJTYZSYJSTNX-UHFFFAOYSA-N