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185-85-3

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Basic Information
CAS No.: 185-85-3
Name: 1-Oxaspiro[2.6]nonane
Molecular Structure:
Molecular Structure of 185-85-3 (1-Oxaspiro[2.6]nonane)
Formula: C8H14O
Molecular Weight: 126.199
Synonyms: 2-oxaspiro[2.6]nonane;1-oxaspiro[2.6]nonan;1-oxa-spiro[2.6]nonane;
Density: 0.97 g/cm3
Boiling Point: 160.1 °C at 760 mmHg
Flash Point: 38.4 °C
PSA: 12.53000
LogP: 2.10960
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Specification

The 1-Oxaspiro[2.6]nonane, with the CAS registry number 185-85-3, has the molecular formula C8H14O. In addition, this chemical's molecular weight is 126.1962. Its systematic name is called 1-oxaspiro[2.6]nonane.

Physical properties of 1-Oxaspiro[2.6]nonane: (1)ACD/LogP: 1.84; (2)ACD/LogD (pH 5.5): 1.84; (3)ACD/LogD (pH 7.4): 1.84; (4)ACD/BCF (pH 5.5): 14.73; (5)ACD/BCF (pH 7.4): 14.73; (6)ACD/KOC (pH 5.5): 238.67; (7)ACD/KOC (pH 7.4): 238.67; (8)#H bond acceptors: 1; (9)Index of Refraction: 1.477; (10)Molar Refractivity: 36.74 cm3; (11)Molar Volume: 130 cm3; (12)Surface Tension: 31.4 dyne/cm; (13)Density: 0.97 g/cm3; (14)Flash Point: 38.4 °C; (15)Enthalpy of Vaporization: 38.04 kJ/mol; (16)Boiling Point: 160.1 °C at 760 mmHg; (17)Vapour Pressure: 3.15 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O2C1(CCCCCC1)C2
(2)InChI: InChI=1/C8H14O/c1-2-4-6-8(5-3-1)7-9-8/h1-7H2
(3)InChIKey: DULNQKPEYCYFFO-UHFFFAOYAR