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CAS No.: | 45513-32-4 |
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Name: | 3-Aminomethyl-3-hydroxymethyloxetane |
Molecular Structure: | |
Formula: | C5H11NO2 |
Molecular Weight: | 117.1463 |
Synonyms: | (3-Aminomethyloxetan-3-yl)methanol; |
Density: | 1.128 g/cm3 |
Boiling Point: | 217 °C at 760 mmHg |
Flash Point: | 85 °C |
PSA: | 55.48000 |
LogP: | -0.34570 |
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The [3-(Aminomethyl)oxetan-3-yl]methanol, with the CAS registry number 45513-32-4, is also known as 3-Oxetanemethanol, 3-(aminomethyl)-. It belongs to the product categories of Aminomethyl's; Ring Systems. This chemical's molecular formula is C5H11NO2 and molecular weight is 117.1463. Its systematic name is called [3-(aminomethyl)oxetan-3-yl]methanol.
Physical properties of [3-(Aminomethyl)oxetan-3-yl]methanol: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 1; (4)ACD/KOC (pH 7.4): 1; (5)#H bond acceptors: 3; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 4; (8)Index of Refraction: 1.486; (9)Molar Refractivity: 29.8 cm3; (10)Molar Volume: 103.7 cm3; (11)Surface Tension: 55.7 dyne/cm; (12)Density: 1.128 g/cm3; (13)Flash Point: 85 °C; (14)Enthalpy of Vaporization: 52.72 kJ/mol; (15)Boiling Point: 217 °C at 760 mmHg; (16)Vapour Pressure: 0.0292 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: NCC1(CO)COC1
(2)InChI: InChI=1/C5H11NO2/c6-1-5(2-7)3-8-4-5/h7H,1-4,6H2
(3)InChIKey: GGYZOSLAJSUXRM-UHFFFAOYAQ