9-(2-chloroethyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione

Base Information

• Chemical Name: 9-(2-chloroethyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
• CAS No.: 15858-11-4
• Molecular Formula: C9H11ClN4O2
• DSSTox Substance ID: DTXSID20577340
• Wikidata: Q82467302
• Mol file: 15858-11-4.mol

Synonyms:9-(2-chloroethyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione;15858-11-4;SCHEMBL8679546;DTXSID20577340;AKOS025251240

Chemical Property of 9-(2-chloroethyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione

Chemical Property:

• XLogP3: 0.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 242.0570533
• Heavy Atom Count: 16
• Complexity: 325

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=C(C(=O)N(C1=O)C)N=CN2CCCl

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