Oxazole,4-(2-bromophenyl)- supplier

Name
4-(2-BROMO-PHENYL)-OXAZOLE
EINECS
CAS No. 850349-06-3
Density 1.524 g/cm³
Solubility
Melting Point
Formula C₉H₆BrNO
Boiling Point 300.3 °C at 760 mmHg
Molecular Weight 224.05404
Flash Point 135.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-(2-Bromophenyl)-oxazole;
PSA 26.03000
LogP 3.10410

Oxazole,4-(2-bromophenyl)- Specification

The Oxazole,4-(2-bromophenyl)-, with the CAS registry number of 850349-06-3, is also known as 4-(2-Bromophenyl)-oxazole. This chemical's molecular formula is C₉H₆BrNO and molecular weight is 224.05404. What's more, its IUPAC name is 4-(2-Bromophenyl)-1,3-oxazole.

Physical properties about the Oxazole,4-(2-bromophenyl)- are: (1)ACD/LogP: 2.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.45; (4)ACD/LogD (pH 7.4): 2.45; (5)ACD/BCF (pH 5.5): 42.6; (6)ACD/BCF (pH 7.4): 42.6; (7)ACD/KOC (pH 5.5): 510.47; (8)ACD/KOC (pH 7.4): 510.47; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.03 Å²; (13)Index of Refraction: 1.58; (14)Molar Refractivity: 48.92 cm³; (15)Molar Volume: 146.9 cm³; (16)Surface Tension: 44.4 dyne/cm; (17)Density: 1.524 g/cm³; (18)Flash Point: 135.4 °C; (19)Enthalpy of Vaporization: 51.87 kJ/mol; (20)Boiling Point: 300.3 °C at 760 mmHg; (21)Vapour Pressure: 0.00202 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1ccccc1c2cocn2
(2) InChI: InChI=1/C9H6BrNO/c10-8-4-2-1-3-7(8)9-5-12-6-11-9/h1-6H
(3) InChIKey: NNVPRFQLCUJXQC-UHFFFAOYAQ

Product Name

4-(2-BROMO-PHENYL)-OXAZOLE

Oxazole,4-(2-bromophenyl)- Specification

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