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Name |
Acetamide, 2-chloro-N-tricyclo[3.3.1.13,7]dec-2-yl- |
EINECS | N/A |
CAS No. | 103951-51-5 | Density | 1.19 g/cm3 |
PSA | 32.59000 | LogP | 3.00640 |
Solubility | N/A | Melting Point |
N/A |
Formula | C12H18ClNO | Boiling Point | 393.9 °C at 760 mmHg |
Molecular Weight | 227.73 | Flash Point | 192 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
NSC187506; |
This chemical is called Acetamide, 2-chloro-N-tricyclo[3.3.1.13,7]dec-2-yl-, and its systematic name is 2-chloro-N-(tricyclo[3.3.1.13,7]dec-2-yl)acetamide. With the molecular formula of C12H18ClNO, its molecular weight is 227.73. The CAS registry number of this chemical is 103951-51-5.
Other characteristics of the Acetamide, 2-chloro-N-tricyclo[3.3.1.13,7]dec-2-yl- can be summarised as followings: (1)ACD/LogP: 2.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.08; (4)ACD/LogD (pH 7.4): 2.08; (5)ACD/BCF (pH 5.5): 22.36; (6)ACD/BCF (pH 7.4): 22.36; (7)ACD/KOC (pH 5.5): 321.78; (8)ACD/KOC (pH 7.4): 321.78; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.544; (14)Molar Refractivity: 59.97 cm3; (15)Molar Volume: 189.9 cm3; (16)Polarizability: 23.77×10-24cm3; (17)Surface Tension: 42.2 dyne/cm; (18)Density: 1.19 g/cm3; (19)Flash Point: 192 °C; (20)Enthalpy of Vaporization: 64.39 kJ/mol; (21)Boiling Point: 393.9 °C at 760 mmHg; (22)Vapour Pressure: 2.05E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: ClCC(=O)NC3C1CC2CC3CC(C1)C2
2.InChI: InChI=1/C12H18ClNO/c13-6-11(15)14-12-9-2-7-1-8(4-9)5-10(12)3-7/h7-10,12H,1-6H2,(H,14,15)
3.InChIKey: IPWVZXFHPBHQRD-UHFFFAOYAS