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Acetamide, 2-chloro-N-tricyclo[3.3.1.13,7]dec-2-yl-

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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 Molecular Structure of 103951-51-5 (N-ADAMANTAN-2-YL-2-CHLORO-ACETAMIDE) Hazard Symbols N/A
Synonyms

NSC187506;

 

Acetamide, 2-chloro-N-tricyclo[3.3.1.13,7]dec-2-yl- Specification

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

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