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1,4-Dioxa-7-azaspiro[4.4]nonane

  • Name 1,4-Dioxa-7-azaspiro[4.4]nonane
  • EINECSN/A
  • CAS No. 176-33-0
  • Density1.161 g/cm3
  • PSA30.49000
  • LogP0.05160
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC6H11NO2
  • Boiling Point206.714 °C at 760 mmHg
  • Molecular Weight129.159
  • Flash Point72 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety39
  • Risk Codes Xi:;
  • Molecular Structure
    Molecular Structure of 176-33-0 (1,4-DIOXA-7-AZA-SPIRO[4.4]NONANE)
  • Hazard SymbolsIrritantXi
  • SynonymsIrritantXi
  • Article Data7

1,4-Dioxa-7-azaspiro[4.4]nonane Specification

The 1, 4-Dioxa-7-azaspiro[4.4]nonane, with the CAS registry number 176-33-0, is also known as 1, 4-Dioxa-7-aza-spiro[4.4]nonane. This chemical's molecular formula is C6H11NO2 and molecular weight is 129.16. What's more, its systematic name is 1, 4-Dioxa-7-azaspiro[4.4]nonane. In addition, this chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about 1, 4-Dioxa-7-azaspiro[4.4]nonane are: (1)ACD/LogP: -0.13; (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: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 0; (10)Polar Surface Area: 30.49 Å2; (11)Index of Refraction: 1.503; (12)Molar Refractivity: 32.88 cm3; (13)Molar Volume: 111.24 cm3; (14)Polarizability: 13.035×10-24 cm3; (15)Surface Tension: 38.133 dyne/cm; (16)Density: 1.161 g/cm3; (17)Flash Point: 72 °C; (18)Enthalpy of Vaporization: 44.296 kJ/mol; (19)Boiling Point: 206.714 °C at 760 mmHg; (20)Vapour Pressure: 0.234 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: C1CNCC12OCCO2
(2) InChI: InChI=1/C6H11NO2/c1-2-7-5-6(1)8-3-4-9-6/h7H,1-5H2
(3) InChIKey: JTOUWLZSXWMCSH-UHFFFAOYAH

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