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2-Oxazolemethanamine

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Name

2-Oxazolemethanamine

EINECS N/A
CAS No. 885331-17-9 Density 1.148g/cm3
PSA 52.05000 LogP 0.83360
Solubility N/A Melting Point N/A
Formula C4H7ClN2O Boiling Point 153 °C at 760 mmHg
Molecular Weight 98.1044 Flash Point 46.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes 22
Molecular Structure Molecular Structure of 885331-17-9 (OXAZOL-2-YL-METHYLAMINE HYDROCHLORIDE) Hazard Symbols Xn
Synonyms

2-(Aminomethyl)oxazole;Oxazol-2-ylmethanamine;[(Oxazol-2-yl)methyl]amine;1-(1,3-oxazol-2-yl)methanamine;

 

2-Oxazolemethanamine Specification

The 2-Oxazolemethanamine, with the CAS registry number 885331-17-9, has the systematic name of 1-(1,3-oxazol-2-yl)methanamine. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of this chemical is C4H7ClN2O.

The physical properties of 2-Oxazolemethanamine are as followings: (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): 9.09; (6)#H bond acceptors: 3; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 52.05 Å2; (10)Index of Refraction: 1.499; (11)Molar Refractivity: 25.09 cm3; (12)Molar Volume: 85.4 cm3; (13)Polarizability: 9.94×10-24cm3; (14)Surface Tension: 44.9 dyne/cm; (15)Density: 1.148 g/cm3; (16)Flash Point: 46.4 °C; (17)Enthalpy of Vaporization: 38.98 kJ/mol; (18)Boiling Point: 153 °C at 760 mmHg; (19)Vapour Pressure: 3.4 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: NCc1ncco1
(2)InChI: InChI=1/C4H6N2O/c5-3-4-6-1-2-7-4/h1-2H,3,5H2
(3)InChIKey: ZLKZGKDNYHEPFV-UHFFFAOYAU

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