Basic Information | Post buying leads | Suppliers |
Name |
4,7-Methano-1H-inden-5-ol,octahydro-, 5-acetate |
EINECS | 264-598-7 |
CAS No. | 64001-15-6 | Density | 1.09 g/cm3 |
PSA | 26.30000 | LogP | 2.37420 |
Solubility | 89.2mg/L at 24℃ | Melting Point |
N/A |
Formula | C12H18O2 | Boiling Point | 255.5 °C at 760 mmHg |
Molecular Weight | 194.274 | Flash Point | 103.8 °C |
Transport Information | N/A | Appearance | from colorless to yellowish mobile liquid |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4,7-Methano-1H-inden-5-ol,octahydro-, acetate (9CI);Dihydro Cyclacet; |
The 4, 7-Methano-1H-inden-5-ol, octahydro-, 5-acetate, with the CAS registry number 64001-15-6, is also known as Tricyclo[5.2.1.02,6]dec-8-yl acetate. And its EINECS registry number is 264-598-7. This chemical's molecular formula is C12H18O2 and molecular weight is 194.27. What's more, its systematic name is Octahydro-1H-4, 7-methanoinden-5-yl acetate.
Physical properties about 4, 7-Methano-1H-inden-5-ol, octahydro-, 5-acetate are: (1)ACD/LogP: 3.07; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.07; (4)ACD/LogD (pH 7.4): 3.07; (5)ACD/BCF (pH 5.5): 127.47; (6)ACD/BCF (pH 7.4): 127.47; (7)ACD/KOC (pH 5.5): 1118.53; (8)ACD/KOC (pH 7.4): 1118.53; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.513; (14)Molar Refractivity: 53.22 cm3; (15)Molar Volume: 176.9 cm3; (16)Polarizability: 21.09×10-24 cm3; (17)Surface Tension: 37.3 dyne/cm; (18)Density: 1.09 g/cm3; (19)Flash Point: 103.8 °C; (20)Enthalpy of Vaporization: 49.29 kJ/mol; (21)Boiling Point: 255.5 °C at 760 mmHg; (22)Vapour Pressure: 0.0163 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OC3CC1CC3C2CCCC12)C
(2) InChI: InChI=1/C12H18O2/c1-7(13)14-12-6-8-5-11(12)10-4-2-3-9(8)10/h8-12H,2-6H2,1H3
(3) InChIKey: YKFHIJHJBUDXFP-UHFFFAOYAP