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tert-Butyl (1-formylcyclopropyl)carbamate

  • Name tert-Butyl (1-formylcyclopropyl)carbamate
  • EINECSN/A
  • CAS No. 107259-06-3
  • Density1.102 g/cm3
  • PSA55.40000
  • LogP1.63350
  • SolubilityN/A
  • Melting Point76.5-78.50℃
  • FormulaC9H15NO3
  • Boiling Point280.708 °C at 760 mmHg
  • Molecular Weight185.223
  • Flash Point123.568 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 107259-06-3 (tert-Butyl (1-formylcyclopropyl)carbamate)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data29

tert-Butyl (1-formylcyclopropyl)carbamate Specification

This chemical is called tert-Butyl (1-formylcyclopropyl)carbamate, and its CAS registry number is 107259-06-3. With the molecular formula of C9H15NO3, its molecular weight is 185.22. 

Other characteristics of the tert-Butyl (1-formylcyclopropyl)carbamate can be summarised as followings: (1)ACD/LogP: 0.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 2; (6)ACD/BCF (pH 7.4): 2; (7)ACD/KOC (pH 5.5): 59; (8)ACD/KOC (pH 7.4): 59; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 55.4 Å2; (13)Index of Refraction: 1.477; (14)Molar Refractivity: 47.538 cm3; (15)Molar Volume: 168.094 cm3; (16)Polarizability: 18.846×10-24cm3; (17)Surface Tension: 37.556 dyne/cm; (18)Density: 1.102 g/cm3; (19)Flash Point: 123.568 °C; (20)Enthalpy of Vaporization: 51.946 kJ/mol; (21)Boiling Point: 280.708 °C at 760 mmHg; (22)Vapour Pressure: 0.004 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=CC1(NC(=O)OC(C)(C)C)CC1
2.InChI: InChI=1/C9H15NO3/c1-8(2,3)13-7(12)10-9(6-11)4-5-9/h6H,4-5H2,1-3H3,(H,10,12)
3.InChIKey: ACMHCEYCNRURST-UHFFFAOYAS

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