2-Hydroperoxy-2,6,6-trimethyl-norpinane supplier

Name
Pinanehydroperoxide
EINECS
CAS No. 5405-84-5
Density 1.04 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₈O₂
Boiling Point 237 °C at 760 mmHg
Molecular Weight 170.252
Flash Point 97.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Hydroperoxide, 2,6,6-trimethylbicyclo(3.1.1)hept-2-yl;
PSA 29.46000
LogP 2.69080

2-Hydroperoxy-2,6,6-trimethyl-norpinane Specification

The 2-Hydroperoxy-2,6,6-trimethyl-norpinane, with the CAS registry number of 5405-84-5, is also known as Hydroperoxide, 2,6,6-trimethylbicyclo(3.1.1)hept-2-yl. Its molecular formula is C₁₀H₁₈O₂ and molecular weight is 170.2487. What's more, its IUPAC name is 4-Hydroperoxy-4,6,6-trimethylbicyclo[3.1.1]heptane.

Physical properties about the 2-Hydroperoxy-2,6,6-trimethyl-norpinane are: (1)ACD/LogP: 3.64; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 18.46 Å²; (7)Index of Refraction: 1.496; (8)Molar Refractivity: 47.5 cm³; (9)Molar Volume: 162.3 cm³; (10)Surface Tension: 35.8 dyne/cm; (11)Density: 1.04 g/cm³; (12)Flash Point: 97.1 °C; (13)Enthalpy of Vaporization: 55.07 kJ/mol; (14)Boiling Point: 237 °C at 760 mmHg; (15)Vapour Pressure: 0.00824 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OOC2(CCC1CC2C1(C)C)C
(2) InChI: InChI=1/C10H18O2/c1-9(2)7-4-5-10(3,12-11)8(9)6-7/h7-8,11H,4-6H2,1-3H3
(3) InChIKey: QMQTYHMGPDPPPW-UHFFFAOYAC

Product Name

Pinanehydroperoxide

2-Hydroperoxy-2,6,6-trimethyl-norpinane Specification

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