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CAS No.: | 1046153-00-7 |
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Name: | 6-Oxa-1-aza-spiro[3,3]heptane |
Molecular Structure: | |
Formula: | C5H9NO |
Molecular Weight: | 99.13 |
Synonyms: | 6-Oxa-1-azaspiro[3.3]heptan; |
Density: | 1.12 g/cm3 |
Boiling Point: | 164.1 °C at 760 mmHg |
Flash Point: | 50.5 °C |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 117.12000 |
LogP: | -0.68940 |
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This product is an organic compound with the formula C5H9NO. The systematic name of this chemical is 6-Oxa-1-aza-spiro[3,3]heptane. With the CAS registry number 1046153-00-7, it is also named as 6-Oxa-1-azaspiro[3.3]heptan. In addition, the molecular weight is 99.13.
Physical properties of 6-Oxa-1-aza-spiro[3,3]heptane are: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 0; (5)Polar Surface Area: 21.26 Å2; (6)Index of Refraction: 1.513; (7)Molar Refractivity: 26.5 cm3; (8)Molar Volume: 88 cm3; (9)Polarizability: 10.5×10-24 cm3; (10)Surface Tension: 36.2 dyne/cm; (11)Density: 1.12 g/cm3; (12)Flash Point: 50.5 °C; (13)Enthalpy of Vaporization: 40.06 kJ/mol; (14)Boiling Point: 164.1 °C at 760 mmHg; (15)Vapour Pressure: 2 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: C1CNC12COC2
(2)InChI: InChI=1S/C5H9NO/c1-2-6-5(1)3-7-4-5/h6H,1-4H2
(3)InChIKey: BCIIWQHRWPXARK-UHFFFAOYSA-N