8-Chloro-9h-purine

Base Information

• Chemical Name: 8-Chloro-9h-purine
• CAS No.: 17587-87-0
• Molecular Formula: C₅H₃ClN₄
• Molecular Weight: 154.559
• Hs Code.: 2933990090
• NSC Number: 27610
• DSSTox Substance ID: DTXSID00282723
• Nikkaji Number: J457.092H
• Wikidata: Q72458131
• Mol file: 17587-87-0.mol

Synonyms:8-chloro-9h-purine;17587-87-0;8-CHLOROPURINE;8-chloro-7H-purine;9H-Purine, 8-chloro-;NSC27610;SCHEMBL357003;DTXSID00282723;MFCD23701481;NSC-27610;SY273994;A881549

Chemical Property of 8-Chloro-9h-purine

Chemical Property:

• Vapor Pressure: 9.79E-06mmHg at 25°C
• Boiling Point: 372.2°Cat760mmHg
• PKA: 5.81±0.20(Predicted)
• Flash Point: 210.6°C
• PSA: 54.46000
• Density: 1.653g/cm³
• LogP: 1.00630
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 154.0046238
• Heavy Atom Count: 10
• Complexity: 131

Purity/Quality:

99%, ^*data from raw suppliers

8-Chloro-9H-purine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C2C(=NC=N1)N=C(N2)Cl
• Uses: 8-Chloropurine can be used as potential anticarcinogens.