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| CAS No.: | 283-38-5 |
|---|---|
| Name: | 1,4-Diazobicylco[3.2.2]nonane |
| Article Data: | 38 |
| Molecular Structure: | |
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| Formula: | C7H14N2 |
| Molecular Weight: | 126.202 |
| Synonyms: | 1,4-Diaza-bicyclo[3.2.2]nonane; |
| Density: | 1.03 g/cm3 |
| Boiling Point: | 180 °C at 760 mmHg |
| Flash Point: | 71.9 °C |
| PSA: | 15.27000 |
| LogP: | 0.32070 |
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Specification
The 1, 4-Diazabicyclo[3.2.2]nonane has CAS registry number 283-38-5. This chemical's molecular formula is C7H14N2 and molecular weight is 126.20. What's more, its systematic name is 1, 4-Diazabicyclo[3.2.2]nonane.
Physical properties about 1, 4-Diazabicyclo[3.2.2]nonane are: (1)ACD/LogP: 0.56; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 0; (10)Polar Surface Area: 6.48 Å2; (11)Index of Refraction: 1.533; (12)Molar Refractivity: 37.87 cm3; (13)Molar Volume: 121.8 cm3; (14)Polarizability: 15.01×10-24 cm3; (15)Surface Tension: 38.6 dyne/cm; (16)Density: 1.03 g/cm3; (17)Flash Point: 71.9 °C; (18)Enthalpy of Vaporization: 41.63 kJ/mol; (19)Boiling Point: 180 °C at 760 mmHg; (20)Vapour Pressure: 0.915 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: C1CN2CCC1NCC2
(2) InChI: InChI=1/C7H14N2/c1-4-9-5-2-7(1)8-3-6-9/h7-8H,1-6H2
(3) InChIKey: XJKNACDCUAFDHD-UHFFFAOYAJ