2'-Deoxy-2'-fluoroadenosine triphosphate

Base Information

• Chemical Name: 2'-Deoxy-2'-fluoroadenosine triphosphate
• CAS No.: 73449-07-7
• Molecular Formula: C10H15 F N5 O12 P3
• Molecular Weight: 509.17
• DSSTox Substance ID: DTXSID50994203
• Nikkaji Number: J1.320.586H
• Wikidata: Q82985053
• ChEMBL ID: CHEMBL4576110
• Mol file: 73449-07-7.mol

Synonyms:2'-deoxy-2'-fluoroadenosine triphosphate;2'-fluoro-2'-deoxyadenosine triphosphate;2-DFLADTP;2-fluoro-dATP

Chemical Property of 2'-Deoxy-2'-fluoroadenosine triphosphate

Chemical Property:

• XLogP3: -4.7
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 8
• Exact Mass: 508.99141009
• Heavy Atom Count: 31
• Complexity: 805

Purity/Quality:

97% ^*data from raw suppliers

2'-Deoxy-2'-fluoroadenosine-5'-triphosphate tetralithium salt ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)F)N
• Isomeric SMILES: C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)F)N