ChemicalBook--->CAS DataBase List--->1394003-78-1

1394003-78-1

1394003-78-1 Structure

1394003-78-1 Structure
IdentificationBack Directory
[Name]

3-chloro-8-fluoroisoquinoline
[CAS]

1394003-78-1
[Synonyms]

3-chloro-8-fluoroisoquinoline
Isoquinoline, 3-chloro-8-fluoro-
[Molecular Formula]

C9H5ClFN
[MDL Number]

MFCD22543893
[MOL File]

1394003-78-1.mol
[Molecular Weight]

181.59
Chemical PropertiesBack Directory
[Boiling point ]

295.6±20.0 °C(Predicted)
[density ]

1.366±0.06 g/cm3(Predicted)
[pka]

1.30±0.50(Predicted)
[InChI]

InChI=1S/C9H5ClFN/c10-9-4-6-2-1-3-8(11)7(6)5-12-9/h1-5H
[InChIKey]

KPWUPANJZPWPEM-UHFFFAOYSA-N
[SMILES]

C1C2=C(C=CC=C2F)C=C(Cl)N=1
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