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3-Bromoquinolin-5-amine

3-Bromoquinolin-5-amine structure

CAS No:
116632-57-6
Formula:
C9H7BrN2
Chemical Name:
3-Bromoquinolin-5-amine
Synonyms:
3-bromoquinolin-5-amine;3-bromo-[5]quinolylamine;5-Quinolinamine, 3-bromo-;DTXSID20858601;MFCD20327979;ZINC95616301;AKOS025146724;QC-8346;AK164713;AS-32790
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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3-Bromoquinolin-5-amine Basic Attributes

Molecular Weight：

223.06928

Exact Mass：

221.979248

DSSTox ID：

DTXSID20858601

Characteristics

PSA：

38.9

XLogP3：

1.9

Density：

1.649±0.06 g/cm3(Predicted)

Boiling Point：

352.5±27.0 °C(Predicted)

Flash Point：

167.0±23.7 °C

Refractive Index：

1.732

3-Bromoquinolin-5-amine Use and Manufacturing

A solution of copper (II) chloride (173 mg, 1.29 mmol) in acetonitrile (4 mL) was cooled to 0 C., tert-butyl nitrite (199 muL, 1.68 mmol) was added dropwise, and the mixture was stirred at 0 C. for 30 min .

Computed Properties

Molecular Weight:223.07
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:221.97926
Monoisotopic Mass:221.97926
Topological Polar Surface Area:38.9
Heavy Atom Count:12
Complexity:163
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes