5'-Chloro-5'-deoxythymidine

Base Information

• Chemical Name: 5'-Chloro-5'-deoxythymidine
• CAS No.: 25905-50-4
• Molecular Formula: C10H13ClN2O4
• Molecular Weight: 260.677
• ChEMBL ID: CHEMBL507660
• DSSTox Substance ID: DTXSID50573855
• Nikkaji Number: J1.298.971G
• Wikidata: Q82462701
• Mol file: 25905-50-4.mol

Synonyms:5'-Chloro-5'-deoxythymidine;25905-50-4;CHEMBL507660;DTXSID50573855

Chemical Property of 5'-Chloro-5'-deoxythymidine

Chemical Property:

• PSA: 84.58000
• LogP: 0.14450
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 260.0563846
• Heavy Atom Count: 17
• Complexity: 385

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CN(C(=O)NC1=O)C2CC(C(O2)CCl)O
• Isomeric SMILES: CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CCl)O

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