7-O-(3-Amino-2,3,6-trideoxy-2-fluorotalopyranosyl)daunomycinone

Base Information

• Chemical Name: 7-O-(3-Amino-2,3,6-trideoxy-2-fluorotalopyranosyl)daunomycinone
• CAS No.: 124264-70-6
• Molecular Formula: C27H28 F N O10 . Cl H
• Molecular Weight: 597.9706632
• DSSTox Substance ID: DTXSID40154258
• Mol file: 124264-70-6.mol

Synonyms:7-ATFTD;7-O-(3-amino-2,3,6-trideoxy-2-fluoro-alpha-L-talopyranosyl)daunomycinone;7-O-(3-amino-2,3,6-trideoxy-2-fluorotalopyranosyl)daunomycinone

Chemical Property of 7-O-(3-Amino-2,3,6-trideoxy-2-fluorotalopyranosyl)daunomycinone

Chemical Property:

• Vapor Pressure: 2.59E-23mmHg at 25°C
• Boiling Point: 745°Cat760mmHg
• Flash Point: 404.4°C
• PSA: 206.07000
• Density: g/cm³
• LogP: 1.97010
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 4
• Exact Mass: 597.1413166
• Heavy Atom Count: 41
• Complexity: 1030

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(C(C(O1)OC2CC(C(C3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)O)(C(=O)C)O)F)N)O.Cl
• Isomeric SMILES: C[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)O[C@H]2C[C@@]([C@@H](C3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)O)(C(=O)C)O)F)N)O.Cl

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