The IUPAC name of 2-Methylideneadamantane is 2-methylideneadamantane. With the CAS registry number 875-72-9, it is also named as Tricyclo(3.3.1.13,7)decane, 2-methylene-. In addition, its molecular formula is C11H16 and molecular weight is 148.24.
The other characteristics of this product can be summarized as: (1)ACD/LogP: 4.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.32; (4)ACD/LogD (pH 7.4): 4.32; (5)ACD/BCF (pH 5.5): 1122.28; (6)ACD/BCF (pH 7.4): 1122.28; (7)ACD/KOC (pH 5.5): 5307.15; (8)ACD/KOC (pH 7.4): 5307.15; (9)H bond acceptors: 0; (10)H bond donors: 0; (11)Freely Rotating Bonds: 0; (12)Index of Refraction: 1.522; (13)Molar Refractivity: 46.29 cm3; (14)Molar Volume: 151.6 cm3; (15)Polarizability: 18.35×10-24cm3; (16)Surface Tension: 31.5 dyne/cm; (17)Density: 0.97 g/cm3; (18)Flash Point: 67.2 °C; (19)Enthalpy of Vaporization: 42.17 kJ/mol; (20)Boiling Point: 203.4 °C at 760 mmHg; (21)Vapour Pressure: 0.396 mmHg at 25 °C.
Preparation of 2-Methylideneadamantane: this chemical can be prepared by 2-Methyl-2-hydroxyadamantane.
This reaction needs I2 and Xylene by heating.
Uses of 2-Methylideneadamantane: it can be used for producing Bromomethylidene-adamantane.
This reaction needs NBS, (PhCO)2O2 and Benzene.
People can use the following data to convert to the molecule structure.
(1)SMILES:C=C1/C2CC3CC1CC(C2)C3
(2)InChI:InChI=1/C11H16/c1-7-10-3-8-2-9(5-10)6-11(7)4-8/h8-11H,1-6H2
(3)InChIKey:JTCQPLINQYIRDZ-UHFFFAOYAH
(4)Std. InChI:InChI=1S/C11H16/c1-7-10-3-8-2-9(5-10)6-11(7)4-8/h8-11H,1-6H2
(5)Std. InChIKey:JTCQPLINQYIRDZ-UHFFFAOYSA-N
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