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CAS No.: | 16887-36-8 |
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Name: | 1-Adamantyl methacrylate |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C14H20O2 |
Molecular Weight: | 220.312 |
Synonyms: | Methacrylicacid, 1-adamantyl ester (8CI);Adamantate AM;1-Adamantyl methacrylate;1-(Methacryloyloxy)adamantane;1-Adamantanol, methacrylate (8CI); |
Density: | 1.08 g/cm3 |
Boiling Point: | 289.26 °C at 760 mmHg |
Flash Point: | 116.921 °C |
PSA: | 26.30000 |
LogP: | 3.07450 |
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The 2-Propenoic acid,2-methyl-, tricyclo[3.3.1.13,7]dec-1-yl ester, with the CAS registry number 16887-36-8, is also known as 1-(Methacryloyloxy)adamantane. This chemical's molecular formula is C14H20O2 and molecular weight is 220.31. What's more, its systematic name is Adamantan-1-yl methacrylate.
Physical properties of 2-Propenoic acid,2-methyl-, tricyclo[3.3.1.13,7]dec-1-yl ester are: (1)ACD/LogP: 4.228; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.23; (4)ACD/LogD (pH 7.4): 4.23; (5)ACD/BCF (pH 5.5): 962.94; (6)ACD/BCF (pH 7.4): 962.94; (7)ACD/KOC (pH 5.5): 4756.20; (8)ACD/KOC (pH 7.4): 4756.20; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.521; (14)Molar Refractivity: 62.08 cm3; (15)Molar Volume: 204.006 cm3; (16)Polarizability: 24.61×10-24cm3; (17)Surface Tension: 37.07 dyne/cm; (18)Density: 1.08 g/cm3; (19)Flash Point: 116.921 °C; (20)Enthalpy of Vaporization: 52.855 kJ/mol; (21)Boiling Point: 289.26 °C at 760 mmHg; (22)Vapour Pressure: 0.002 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC13CC2CC(CC(C1)C2)C3)\C(=C)C
(2)Std. InChI: InChI=1S/C14H20O2/c1-9(2)13(15)16-14-6-10-3-11(7-14)5-12(4-10)8-14/h10-12H,1,3-8H2,2H3
(3)Std. InChIKey: MZVABYGYVXBZDP-UHFFFAOYSA-N