4-Oxazolemethanamine supplier

Name
OXAZOL-4-YL-METHYLAMINE HYDROCHLORIDE
EINECS
CAS No. 55242-82-5
Article Data1
CAS DataBase
Density 1.148 g/cm³
Solubility
Melting Point
Formula C₄H₆N₂O
Boiling Point 183.45 °C at 760 mmHg
Molecular Weight 98.1044
Flash Point 64.748 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms oxazol-4-ylmethanamine;(1,3-Oxazol-4-yl)methylamine;1,3-oxazol-4-ylmethylamine;4-(Aminomethyl)-1,3-oxazole;oxazol-4-ylmethanamine;
PSA 52.05000
LogP 0.83360

4-Oxazolemethanamine Specification

The Oxazol-4-yl-methylamine, with the CAS registry number 55242-82-5, has the IUPAC name of 1,3-oxazol-4-ylmethanamine. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₄H₆N₂O.

The characteristics of Oxazol-4-yl-methylamine 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): 5.905; (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: 25.095 cm³; (12)Molar Volume: 85.44 cm³; (13)Polarizability: 9.949×10^-24cm³; (14)Surface Tension: 44.964 dyne/cm; (15)Density: 1.148 g/cm³; (16)Flash Point: 64.748 °C; (17)Enthalpy of Vaporization: 41.969 kJ/mol; (18)Boiling Point: 183.45 °C at 760 mmHg; (19)Vapour Pressure: 0.77 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1c(nco1)CN
(2)InChI: InChI=1/C4H6N2O/c5-1-4-2-7-3-6-4/h2-3H,1,5H2
(3)InChIKey: ULZXEYFKBUPRQM-UHFFFAOYAC

Product Name

OXAZOL-4-YL-METHYLAMINE HYDROCHLORIDE

4-Oxazolemethanamine Specification

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