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Basic Information
CAS No.: 134575-13-6
Name: (1R,5S,6R)-3-Azabicyclo[3.1.0]hexan-6-ylmethanol
Article Data: 4
Molecular Structure:
Molecular Structure of 134575-13-6 ((1R,5S,6R)-3-Azabicyclo[3.1.0]hexan-6-ylmethanol)
Formula: C6H11NO
Molecular Weight: 113.159
Synonyms: (1R,5S,6R)-3-Azabicyclo[3.1.0]hexan-6-ylmethanol
Density: 1.108 g/cm3
Boiling Point: 202.5 °C at 760 mmHg
Flash Point: 110.2 °C
PSA: 32.26000
LogP: -0.22710
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Specification

The (1R,5S,6R)-3-Azabicyclo[3.1.0]hexan-6-ylmethanol, with the cas registry number 134575-13-6, has the systematic name of [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol. And the molecular formula of the chemical is C6H11NO.

The characteristics of this chemical are as followings: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 2; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 32.26 Å2; (6)Index of Refraction: 1.513; (7)Molar Refractivity: 30.68 cm3; (8)Molar Volume: 102 cm3; (9)Polarizability: 12.16×10-24cm3; (10)Surface Tension: 43.9 dyne/cm; (11)Density: 1.108 g/cm3; (12)Flash Point: 110.2 °C; (13)Enthalpy of Vaporization: 51.04 kJ/mol; (14)Boiling Point: 202.5 °C at 760 mmHg; (15)Vapour Pressure: 0.071 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: C1C2C(C2CO)CN1
(2)InChI: InChI=1/C6H11NO/c8-3-6-4-1-7-2-5(4)6/h4-8H,1-3H2/t4-,5+,6+
(3)InChIKey: YGYOQZPGFXHQMW-FMCRUOTFBP