3-Chloro-1H-pyrrolo[3,2-c]pyridin-4-ol

Base Information

• Chemical Name: 3-Chloro-1H-pyrrolo[3,2-c]pyridin-4-ol
• CAS No.: 117332-46-4
• Molecular Formula: C7H5ClN2O
• Molecular Weight: 168.5804
• DSSTox Substance ID: DTXSID70556064
• Wikidata: Q82437535
• Mol file: 117332-46-4.mol

Synonyms:3-Chloro-1H-pyrrolo[3,2-c]pyridin-4-ol;117332-46-4;3-chloro-1,5-dihydropyrrolo[3,2-c]pyridin-4-one;DTXSID70556064;3-chloro-1H,4H,5H-pyrrolo[3,2-c]pyridin-4-one;3-Chloro-1,5-dihydro-4H-pyrrolo[3,2-c]pyridin-4-one

Chemical Property of 3-Chloro-1H-pyrrolo[3,2-c]pyridin-4-ol

Chemical Property:

• Melting Point: 261-263 °C(Solv: N,N-dimethylformamide (68-12-2))
• Boiling Point: 538.3±50.0 °C(Predicted)
• PKA: 12.35±0.20(Predicted)
• PSA: 48.91000
• Density: 1.500±0.06 g/cm3(Predicted)
• LogP: 1.92190
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 168.0090405
• Heavy Atom Count: 11
• Complexity: 217

Purity/Quality:

98% ^*data from raw suppliers

3-chloro-1,5-dihydro-4H-Pyrrolo[3,2-c]pyridin-4-one 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CNC(=O)C2=C1NC=C2Cl