2-Hydroxy-1,8-cineole supplier

Name
(1alpha,4alpha,6alpha)-(±)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-ol
EINECS 262-408-7
CAS No. 60761-00-4
Article Data17
CAS DataBase
Density 1.037g/cm³
Solubility
Melting Point
Formula C10H18 O2
Boiling Point 238.7°C at 760 mmHg
Molecular Weight 170.252
Flash Point 89.6°C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Oxabicyclo[2.2.2]octan-6-ol,1,3,3-trimethyl-, (1a,4a,6a)-(?à)-;2-Oxabicyclo[2.2.2]octan-6-ol, 1,3,3-trimethyl-, (1a,4a,6a)-;2-a-Hydroxy-1,8-cineole;NSC 341366;
PSA 29.46000
LogP 1.71490

2-Hydroxy-1,8-cineole Specification

The 2-Hydroxy-1,8-cineole,with the CAS registry number 60761-00-4.It belongs to the product categories of Organic matter.This chemical's molecular formula is C₁₀H₁₈O₂ and molecular weight is 170.24.Its EINECS number is 262-408-7.What's more,its systematic name is (1alpha,4alpha,6alpha)-(1)-1,3,3-Trimethyl-2-oxabicyclo(2.2.2)octan-6-ol.

Physical properties about 2-Hydroxy-1,8-cineole are:(1)ACD/LogP: 1.385; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.39; (4)ACD/LogD (pH 7.4): 1.39; (5)ACD/BCF (pH 5.5): 6.65; (6)ACD/BCF (pH 7.4): 6.65; (7)ACD/KOC (pH 5.5): 135.05; (8)ACD/KOC (pH 7.4): 135.05; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.49; (13)Molar Refractivity: 47.461 cm³; (14)Molar Volume: 164.145 cm³; (15)Polarizability: 18.815 ×10^-24cm³ ; (16)Surface Tension: 37.3619995117188 dyne/cm; (17)Density: 1.037 g/cm³; (18)Flash Point: 89.637 °C; (19)Enthalpy of Vaporization: 55.277 kJ/mol; (20)Boiling Point: 238.747 °C at 760 mmHg; (21)Vapour Pressure: 0.00700000021606684 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:O[C@@H]2[C@]1(OC(C)([C@H](CC1)C2)C)C;
(2)InChI:InChI=1S/C10H18O2/c1-9(2)7-4-5-10(3,12-9)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8+,10+/m1/s1;
(3)InChIKey:YVCUGZBVCHODNB-WEDXCCLWSA-N;

Product Name

(1alpha,4alpha,6alpha)-(±)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-ol

2-Hydroxy-1,8-cineole Specification

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