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CAS No.: | 303186-14-3 |
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Name: | 2-Ethyl-2-adamantyl acrylate |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C15H22O2 |
Molecular Weight: | 234.338 |
Synonyms: | 2-Propenoic acid,2-ethyltricyclo[3.3.1.13,7]dec-2-yl ester;2-Ethyladamantan-2-yl prop-2-enoate;2-Ethyladamantan-2-yl acrylate; |
Density: | 1.06 g/cm3 |
Boiling Point: | 301.864 °C at 760 mmHg |
Flash Point: | 123.039 °C |
PSA: | 26.30000 |
LogP: | 3.32050 |
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The 2-Propenoic acid,2-ethyltricyclo[3.3.1.13,7]dec-2-yl ester, with the CAS registry number 303186-14-3, is also known as 2-Ethyladamantan-2-yl prop-2-enoate. It belongs to the product category of Adamantane Derivative. This chemical's molecular formula is C15H22O2 and molecular weight is 234.33. What's more, its systematic name is 2-Ethyladamantan-2-yl acrylate.
Physical properties of 2-Propenoic acid,2-ethyltricyclo[3.3.1.13,7]dec-2-yl ester are: (1)ACD/LogP: 4.847; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.85; (4)ACD/LogD (pH 7.4): 4.85; (5)ACD/BCF (pH 5.5): 2840.91; (6)ACD/BCF (pH 7.4): 2840.91; (7)ACD/KOC (pH 5.5): 10317.64; (8)ACD/KOC (pH 7.4): 10317.64; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.517; (14)Molar Refractivity: 66.916 cm3; (15)Molar Volume: 221.088 cm3; (16)Polarizability: 26.528×10-24cm3; (17)Surface Tension: 36.97 dyne/cm; (18)Density: 1.06 g/cm3; (19)Flash Point: 123.039 °C; (20)Enthalpy of Vaporization: 54.204 kJ/mol; (21)Boiling Point: 301.864 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: C=CC(=O)OC3(CC)C1CC2CC3CC(C1)C2
(2)Std. InChI: InChI=1S/C15H22O2/c1-3-14(16)17-15(4-2)12-6-10-5-11(8-12)9-13(15)7-10/h3,10-13H,1,4-9H2,2H3
(3)Std. InChIKey: NLNVUFXLNHSIQH-UHFFFAOYSA-N