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408352-90-9

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Basic Information
CAS No.: 408352-90-9
Name: C-(2-PHENYL-OXAZOL-4-YL)-METHYLAMINE
Molecular Structure:
Molecular Structure of 408352-90-9 (C-(2-PHENYL-OXAZOL-4-YL)-METHYLAMINE)
Formula: C10H10N2O
Molecular Weight: 174.2
Synonyms: C-(2-PHENYL-OXAZOL-4-YL)-METHYLAMINE;(2-Phenyloxazol-4-yl)methylamine;4-aminomethyl-2-phenyl-oxazole;1-(2-phenyl-1,3-oxazol-4-yl)methanamine(SALTDATA: HCl);(2-phenyloxazol-4-yl)MethanaMine;4-OxazoleMethanaMine, 2-phenyl-
Density: 1.155 g/cm3
Boiling Point: 326.7 °C at 760 mmHg
Flash Point: 151.4 °C
Hazard Symbols: T
Risk Codes: 25
Safety: 45
PSA: 52.05000
LogP: 2.50060
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Specification

The 4-Oxazolemethanamine,2-phenyl-, with the CAS registry number 408352-90-9, is also known as 1-(2-phenyl-1,3-oxazol-4-yl)methanamine. Its molecular formula is C10H10N2O and its molecular weight is 174.2.

Other characteristics of the 4-Oxazolemethanamine,2-phenyl- can be summarised as followings: (1)ACD/LogP: 1.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.97 ; (4)#H bond acceptors: 3; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 3; (7)Polar Surface Area: 52.05 Å2; (8)Index of Refraction: 1.573; (9)Molar Refractivity: 49.68 cm3; (10)Molar Volume: 150.7 cm3; (11)Polarizability: 19.69×10-24cm3; (12)Surface Tension: 46.9 dyne/cm; (13)Density: 1.155 g/cm3; (14)Flash Point: 151.4 °C; (15)Enthalpy of Vaporization: 56.89 kJ/mol; (16)Boiling Point: 326.7 °C at 760 mmHg; (17)Vapour Pressure: 0.000213 mmHg at 25°C.

You can still convert the following datas into molecular structure:  
1.SMILES: c1ccc(cc1)c2nc(co2)CN
2.InChI: InChI=1/C10H10N2O/c11-6-9-7-13-10(12-9)8-4-2-1-3-5-8/h1-5,7H,6,11H2
3.InChIKey: NGYFPQIRGGHIHK-UHFFFAOYAZ