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185-70-6

Basic Information
CAS No.: 185-70-6
Name: Methylenecyclohexaneoxide
Article Data: 15
Molecular Structure:
Molecular Structure of 185-70-6 (Methylenecyclohexaneoxide)
Formula: C7H12 O
Molecular Weight: 112.172
Synonyms: Cyclohexane,methylene-, oxide; Methylenecyclohexane oxide; NSC 52756; Spiro[cyclohexane-1,a'-ethylene oxide];Spirooxiranecyclohexane
Density: 0.98g/cm3
Boiling Point: 140.7°C at 760 mmHg
Flash Point: 26.5°C
Safety: Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.
PSA: 12.53000
LogP: 1.71950
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Chemistry

Molecule structure of Spirooxiranecyclohexane (CAS NO.185-70-6) :

IUPAC Name: 1-oxaspiro[2.5]octane 
Molecular Weight: 112.16958 g/mol
Molecular Formula: C7H12
Density: 0.98 g/cm3 
Boiling Point: 140.7 °C at 760 mmHg 
Flash Point: 26.5 °C
Index of Refraction: 1.478
Molar Refractivity: 32.11 cm3
Molar Volume: 113.4 cm3
Polarizability: 12.73×10-24 cm3
Surface Tension: 31.1 dyne/cm 
Enthalpy of Vaporization: 36.23 kJ/mol
Vapour Pressure: 7.56 mmHg at 25 °C
H-Bond Acceptor: 1 
Exact Mass: 112.088815
MonoIsotopic Mass: 112.088815
Topological Polar Surface Area: 12.5
Heavy Atom Count: 8
Complexity: 92.6
Canonical SMILES: C1CCC2(CC1)CO2
InChI: InChI=1S/C7H12O/c1-2-4-7(5-3-1)6-8-7/h1-6H2
InChIKey of Spirooxiranecyclohexane (CAS NO.185-70-6) : VUEWYZJJYGPJDC-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

mic-sat 2500 nmol/plate

    MUREAV    Mutation Research. 224 (1989),171.

Safety Profile

Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.
RIDADR: 1993
HazardClass: 3.2
PackingGroup: III

Specification

 Spirooxiranecyclohexane (CAS NO.185-70-6) is also called 1-Oxaspiro(2.5)octane ; 5-17-01-00217 (Beilstein Handbook Reference) ; BRN 0103121 ; CCRIS 3535 ; Methylenecyclohexane oxide ; NSC 52756 ; Oxaspirooctane ; 1-Oxaspiro(2.5)octane ; Cyclohexylidene oxide .