4-chloro-7-methyl-1H-pyrrolo[3,2-c]pyridine
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Basic information
- CAS
1082040-95-6- Standard SMILES
Cc1cnc(Cl)c2cc[nH]c12- InChIKey
FDDUNWBKKCPOCV-UHFFFAOYSA-N- Molecular formula
- C8H7ClN2
- Average molar mass
- 166.61 g/mol
- Monoisotopic mass
- 166.0297759
Names & identifiers
- Preferred name
- 4-chloro-7-methyl-1H-pyrrolo[3,2-c]pyridine
- IUPAC
- 4-chloro-7-methyl-1H-pyrrolo[3,2-c]pyridine
- English name
- 1H-Pyrrolo[3,2-c]pyridine, 4-chloro-7-Methyl-
- Molecular formula
- C8H7ClN2
- Molecular weight
- 166.61
Names & synonyms
1082040-95-64-chloro-7-methyl-1H-pyrrolo[3,2-c]pyridine4-Chloro-7-methyl-5-azaindole1H-Pyrrolo[3,2-c]pyridine, 4-chloro-7-Methyl-MFCD11845525SCHEMBL18479114SCHEMBL30110643TQP0477DTXSID101263903AKOS025149185BS-53238SY251596
Show more names
DB-358241CS-0130997D83438F608116
Database identifiers
- CAS
1082040-95-6- PubChem CID
- 53399459
- DTXSID
DTXSID101263903
Properties
Computed structural propertiesFilling in
- XLogP
- 2.3
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 151
Physicochemical properties
- Boiling point
- 342.3 · 342.3±37.0 °C(Predicted)
- Density
- 1.351 · 1.351±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 14.6 · 14.60±0.40(Predicted)
- Appearance
- Off-white to light yellow Solid
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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