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5-(4-Bromophenyl)oxazole

5-(4-Bromophenyl)oxazole structure

CAS No:
72571-06-3
Formula:
C9H6BrNO
Chemical Name:
5-(4-Bromophenyl)oxazole
Synonyms:
Oxazole,5-(4-bromophenyl)-;5-(4-Bromophenyl)oxazole;5-(p-Bromophenyl)oxazole;5-(4-Bromophenyl)-1,3-oxazole
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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5-(4-Bromophenyl)oxazole Basic Attributes

Molecular Weight：

224.05

Exact Mass：

224.05

DSSTox ID：

DTXSID10380062

HScode：

2934999090

Characteristics

PSA：

XLogP3：

3.10410

Density：

1.524g/cm3

Melting Point：

78.1-78.4 °C

Boiling Point：

315.8ºC at 760 mmHg

Flash Point：

144.8ºC

Refractive Index：

1.58

Water Solubility：

2.2 [ug/mL]

Safety Information

Hazard category：

IRRITANT

hazard class code：

36/37/38-25

safety instructions：

26-36/37/39-45

Marks：

Hazard note：

Harmful

Computed Properties

Molecular Weight:224.05
XLogP3:2.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:222.96328
Monoisotopic Mass:222.96328
Topological Polar Surface Area:26
Heavy Atom Count:12
Complexity:146
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes