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CAS No.: | 135380-52-8 |
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Name: | 7-Benzyl-2,7-diazaspiro[3.5]nonane |
Article Data: | 1 |
Molecular Structure: | |
Formula: | C14H20N2 |
Molecular Weight: | 216.326 |
Synonyms: | 7-Benzyl-2,7-diazaspiro[3.5]nonane; |
Density: | 1.08 g/cm3 |
Boiling Point: | 323.5 °C at 760 mmHg |
Flash Point: | 131.7 °C |
PSA: | 24.06000 |
LogP: | 0.61700 |
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The 2,7-Diazaspiro[3.5]nonane, 7-(phenylmethyl)-, with CAS registry number 135380-52-8, has the systematic name of 7-benzyl-2,7-diazaspiro[3.5]nonane. Its molecular weight is 216.32. And the chemical formula of this chemical is C14H20N2.
Physical properties of 2,7-Diazaspiro[3.5]nonane, 7-(phenylmethyl)-: (1)ACD/LogP: 1.93; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 15.27 Å2; (7)Index of Refraction: 1.592; (8)Molar Refractivity: 67.25 cm3; (9)Molar Volume: 198.5 cm3; (10)Polarizability: 26.66×10-24cm3; (11)Surface Tension: 45.6 dyne/cm; (12)Density: 1.08 g/cm3; (13)Flash Point: 131.7 °C; (14)Enthalpy of Vaporization: 56.54 kJ/mol; (15)Boiling Point: 323.5 °C at 760 mmHg; (16)Vapour Pressure: 0.000261 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(cc1)CN2CCC3(CC2)CNC3
(2)InChI: InChI=1/C14H20N2/c1-2-4-13(5-3-1)10-16-8-6-14(7-9-16)11-15-12-14/h1-5,15H,6-12H2
(3)InChIKey: SSKGDQBPVMFYNR-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C14H20N2/c1-2-4-13(5-3-1)10-16-8-6-14(7-9-16)11-15-12-14/h1-5,15H,6-12H2
(5)Std. InChIKey: SSKGDQBPVMFYNR-UHFFFAOYSA-N