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Name |
2-Hydroxy-1,8-cineole |
EINECS | 262-408-7 |
CAS No. | 60761-00-4 | Density | 1.037g/cm3 |
PSA | 29.46000 | LogP | 1.71490 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H18 O2 | Boiling Point | 238.7°C at 760 mmHg |
Molecular Weight | 170.252 | Flash Point | 89.6°C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
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; |
Article Data | 17 |
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;