4-Oxazolecarboxylicacid, 5-methyl-2-phenyl- supplier

Name
5-METHYL-2-PHENYL-1,3-OXAZOLE-4-CARBOXYLIC ACID
EINECS
CAS No. 18735-74-5
Article Data14
CAS DataBase
Density 1.273 g/cm³
Solubility
Melting Point 182 °C
Formula C₁₁H₉NO₃
Boiling Point 400.1 °C at 760 mmHg
Molecular Weight 203.197
Flash Point 195.8 °C
Transport Information
Appearance
Safety
Risk Codes Harmful:;
Molecular Structure
Hazard Symbols
Synonyms 2-Phenyl-5-methyloxazole-4-carboxylicacid;5-Methyl-2-phenyl-1,3-oxazole-4-carboxylic acid;5-Methyl-2-phenyloxazole-4-carboxylicacid;NSC 255239;
PSA 63.33000
LogP 2.34820

4-Oxazolecarboxylicacid, 5-methyl-2-phenyl- Specification

This chemical is called 4-Oxazolecarboxylicacid, 5-methyl-2-phenyl-, and its systematic name is 4-Oxazolecarboxylicacid, 5-methyl-2-phenyl-. With the molecular formula of C₁₁H₉NO₃, its product categories are Heterocycles series; Carboxylic Acids; Oxazoles, Isoxazoles & Benzoxazoles; Carboxylic Acids; Oxazoles, Isoxazoles & Benzoxazoles. The CAS registry number of this chemical is 18735-74-5.

Other characteristics of the 4-Oxazolecarboxylicacid, 5-methyl-2-phenyl- can be summarised as followings: (1)ACD/LogP: 2.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.36; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 3.96; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 52.33 Å²; (12)Index of Refraction: 1.578; (13)Molar Refractivity: 52.99 cm³; (14)Molar Volume: 159.5 cm³; (15)Polarizability: 21×10^-24cm³; (16)Surface Tension: 52 dyne/cm; (17)Density: 1.273 g/cm³; (18)Flash Point: 195.8 °C; (19)Enthalpy of Vaporization: 68.64 kJ/mol; (20)Boiling Point: 400.1 °C at 760 mmHg; (21)Vapour Pressure: 4.04E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)c1nc(oc1C)c2ccccc2
2.InChI: InChI=1/C11H9NO3/c1-7-9(11(13)14)12-10(15-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,13,14)
3.InChIKey: YABCPNYCFFUVNM-UHFFFAOYAO

Product Name

5-METHYL-2-PHENYL-1,3-OXAZOLE-4-CARBOXYLIC ACID

4-Oxazolecarboxylicacid, 5-methyl-2-phenyl- Specification

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