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724701-02-4

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Basic Information
CAS No.: 724701-02-4
Name: 3-Oxabicyclo[3.1.0]hexan-6-amine
Molecular Structure:
Molecular Structure of 724701-02-4 (3-Oxabicyclo[3.1.0]hexan-6-amine)
Formula: C5H9NO
Molecular Weight: 99.1326
Synonyms: 3-Oxabicyclo[3.1.0]hexan-6-amine
Density: 1.151 g/cm3
Boiling Point: 154.073 °C at 760 mmHg
Flash Point: 57.901 °C
PSA: 35.25000
LogP: 0.29020
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Specification

The CAS registry number of 3-Oxabicyclo[3.1.0]hexan-6-amine is 724701-02-4. This chemical's molecular formula is C5H9NO and molecular weight is 99.1311. What's more, its systematic name is also called 3-Oxabicyclo[3.1.0]hexan-6-amine.

Physical properties about 3-Oxabicyclo[3.1.0]hexan-6-amine are: (1)#of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 2.358; (6)#H bond acceptors: 2; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 35.25 Å2; (10)Index of Refraction: 1.522; (11)Molar Refractivity: 26.269 cm3; (12)Molar Volume: 86.089 cm3; (13)Polarizability: 10.414×10-24 cm3; (14)Surface Tension: 45.35 dyne/cm; (15)Density: 1.151 g/cm3; (16)Flash Point: 57.901 °C; (17)Enthalpy of Vaporization: 39.085 kJ/mol; (18)Boiling Point: 154.073 °C at 760 mmHg; (19)Vapour Pressure: 3.234 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: C1C2C(C2N)CO1
(2) InChI: InChI=1/C5H9NO/c6-5-3-1-7-2-4(3)5/h3-5H,1-2,6H2
(3) InChIKey: UVMHKNOMRGEMLC-UHFFFAOYAW