5-Chloro-3-iodo-2-methylpyrazolo[1,5-a]pyrimidine
Basic information
- CAS
1263282-98-9- Standard SMILES
Cc1nn2ccc(Cl)nc2c1I- InChIKey
FKQSQSUSGOYQFO-UHFFFAOYSA-N- Molecular formula
- C7H5ClIN3
- Average molar mass
- 293.49 g/mol
- Monoisotopic mass
- 292.92167
Names & identifiers
- Preferred name
- 5-Chloro-3-iodo-2-methylpyrazolo[1,5-a]pyrimidine
- IUPAC
- 5-chloro-3-iodo-2-methylpyrazolo[1,5-a]pyrimidine
- English name
- 5-chloro-3-iodo-2-Methylpyrazolo[1,5-a]pyriMidine
- Molecular formula
- C7H5ClIN3
- Molecular weight
- 293.49
Names & synonyms
5-chloro-3-iodo-2-methylpyrazolo[1,5-a]pyrimidine1263282-98-9Pyrazolo[1,5-a]pyrimidine, 5-chloro-3-iodo-2-methyl-MFCD17676712SB14685F85995PS-16826F9505165-chloro-3-iodo-2-methyl-pyrazolo[1,5-a]pyrimidine5-chloro-3-iodo-2-methylpyrazolo[1,5-a]pyrimidine - [C18308]
Database identifiers
- CAS
1263282-98-9- PubChem CID
- 46941646
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 180
Physicochemical properties
- Density
- 2.18 · 2.18±0.1 g/cm3(Predicted)
- pka
- -1.75 · -1.75±0.30(Predicted)
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Compound notes
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