-
Name
2-Fluoroadamantane
- EINECS
- CAS No. 16668-83-0
- Article Data27
- CAS DataBase
- Density 1.05 g/cm3
- Solubility
- Melting Point
- Formula C10H15F
- Boiling Point 197 °C at 760 mmHg
- Molecular Weight 154.228
- Flash Point 68.7 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 2-Fluoroadamantane
- PSA 0.00000
- LogP 2.78060
Tricyclo[3.3.1.13,7]decane,2-fluoro- Specification
The Tricyclo[3.3.1.13,7]decane,2-fluoro- has CAS registry number 16668-83-0. Its molecular formula is C10H15F and molecular weight is 154.224503. What's more, its IUPAC name is 2-Fluoroadamantane.
Physical properties about the Tricyclo[3.3.1.13,7]decane,2-fluoro- are: (1)ACD/LogP: 3.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.41; (4)ACD/LogD (pH 7.4): 3.41; (5)ACD/BCF (pH 5.5): 228.28; (6)ACD/BCF (pH 7.4): 228.28; (7)ACD/KOC (pH 5.5): 1697.48; (8)ACD/KOC (pH 7.4): 1697.48; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.49; (14)Molar Refractivity: 42.22 cm3; (15)Molar Volume: 145.8 cm3; (16)Surface Tension: 29.8 dyne/cm; (17)Density: 1.05 g/cm3; (18)Flash Point: 68.7 °C; (19)Enthalpy of Vaporization: 41.55 kJ/mol; (20)Boiling Point: 197 °C at 760 mmHg; (21)Vapour Pressure: 0.545 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: FC3C1CC2CC3CC(C1)C2
(2) InChI: InChI=1/C10H15F/c11-10-8-2-6-1-7(4-8)5-9(10)3-6/h6-10H,1-5H2
(3) InChIKey: SVIIPBADUQGZCF-UHFFFAOYAN
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