Basic Information | Post buying leads | Suppliers |
Name |
Tricyclo[3.3.1.13,7]decane-1-acetamide,2-oxo- |
EINECS | N/A |
CAS No. | 27174-88-5 | Density | 1.225 g/cm3 |
PSA | 61.15000 | LogP | 2.40690 |
Solubility | N/A | Melting Point |
N/A |
Formula | C12H17NO2 | Boiling Point | 421.7 °C at 760 mmHg |
Molecular Weight | 207.272 | Flash Point | 208.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Oxo-1-Adamantaneacetamide; |
The Tricyclo[3.3.1.13,7]decane-1-acetamide,2-oxo-, with the CAS registry number of 27174-88-5, is also known as 2-Oxo-1-Adamantaneacetamide. Its molecular formula is C12H17NO2 and molecular weight is 207.268880. What's more, its IUPAC name is 2-(2-Oxo-1-adamantyl)acetamide. This chemical's classification code is Drug / Therapeutic Agent.
Physical properties about the Tricyclo[3.3.1.13,7]decane-1-acetamide,2-oxo- are: (1)ACD/LogP: 0.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.03; (4)ACD/LogD (pH 7.4): 0.03; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 24.76; (8)ACD/KOC (pH 7.4): 24.76; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 37.38 Å2; (13)Index of Refraction: 1.565; (14)Molar Refractivity: 55.14 cm3; (15)Molar Volume: 169 cm3; (16)Surface Tension: 51.2 dyne/cm; (17)Density: 1.225 g/cm3; (18)Flash Point: 208.8 °C; (19)Enthalpy of Vaporization: 67.58 kJ/mol; (20)Boiling Point: 421.7 °C at 760 mmHg; (21)Vapour Pressure: 2.55E-07 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N)CC31C(=O)C2CC(C1)CC(C2)C3
(2) InChI: InChI=1/C12H17NO2/c13-10(14)6-12-4-7-1-8(5-12)3-9(2-7)11(12)15/h7-9H,1-6H2,(H2,13,14)
(3) InChIKey: ZJAXUEIBAOYTPD-UHFFFAOYAK