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Basic Information
CAS No.: 130552-00-0
Name: A-PHENYL-2-OXAZOLEMETHANOL 97
Article Data: 2
Molecular Structure:
Molecular Structure of 130552-00-0 (A-PHENYL-2-OXAZOLEMETHANOL 97)
Formula: C10H9NO2
Molecular Weight: 175.187
Synonyms: A-PHENYL-2-OXAZOLEMETHANOL 97;Oxazolidone-2-Yl-Phenylmethanol
Density: 1.224g/cm3
Melting Point: 88-92 °C(lit.)
Boiling Point: 309.124 °C at 760 mmHg
Flash Point: 140.754 °C
Hazard Symbols: HarmfulXn
Risk Codes: 22-36
Safety: 26-36
PSA: 46.26000
LogP: 1.75630
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Specification

The 2-Oxazolemethanol, a-phenyl-, with CAS registry number 130552-00-0, belongs to the following product categories: (1)Building Blocks; (2)Heterocyclic Building Blocks; (3)Oxazoles. It has the systematic name of 1,3-oxazol-2-yl(phenyl)methanol. And the chemical formula of this chemical is C10H9NO2.

Physical properties of 2-Oxazolemethanol, a-phenyl-: (1)ACD/LogP: 0.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 6; (6)ACD/BCF (pH 7.4): 6; (7)ACD/KOC (pH 5.5): 126; (8)ACD/KOC (pH 7.4): 126; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 46.26 Å2; (13)Index of Refraction: 1.578; (14)Molar Refractivity: 47.496 cm3; (15)Molar Volume: 143.108 cm3; (16)Polarizability: 18.829×10-24cm3; (17)Surface Tension: 50.686 dyne/cm; (18)Density: 1.224 g/cm3; (19)Flash Point: 140.754 °C; (20)Enthalpy of Vaporization: 58.057 kJ/mol; (21)Boiling Point: 309.124 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 2-Oxazolemethanol, a-phenyl- irritates to eyes, respiratory system and skin. And this chemical is harmful if swallowed. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: OC(c1ccccc1)c2ncco2
(2)InChI: InChI=1/C10H9NO2/c12-9(10-11-6-7-13-10)8-4-2-1-3-5-8/h1-7,9,12H
(3)InChIKey: WINHVVCCDHHBNG-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C10H9NO2/c12-9(10-11-6-7-13-10)8-4-2-1-3-5-8/h1-7,9,12H
(5)Std. InChIKey: WINHVVCCDHHBNG-UHFFFAOYSA-N