Daunomycin, 3-oxime, monohydrochloride, sesquihydrate

Base Information

• Chemical Name: Daunomycin, 3-oxime, monohydrochloride, sesquihydrate
• CAS No.: 34610-60-1
• Molecular Formula: C27H30 N2 O10 . Cl H
• Molecular Weight: 579
• Mol file: 34610-60-1.mol

Synonyms:Daunorubicin oxime hydrochloride;NSC 143491;Daunomycin, 3-oxime, monohydrochloride;Daunomycin, 3-oxime, monohydrochloride, sesquihydrate;Daunomycin 3-oxime hydrochloride;C27H30N2O10.ClH;C27-H30-N2-O10.Cl-H;34610-60-1;Daunomycin, 3-oxime, monohydrochloride (8CI);SCHEMBL22589723;5,12-Naphthacenedione, 10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(1-(hydroxyimino)ethyl)-1-methoxy-, monohydrochloride, (8S-cis)-

Chemical Property of Daunomycin, 3-oxime, monohydrochloride, sesquihydrate

Chemical Property:

• Vapor Pressure: 6.8E-28mmHg at 25°C
• Boiling Point: 812.4°Cat760mmHg
• Flash Point: 445.1°C
• PSA: 201.36000
• Density: 1.65g/cm³
• LogP: 2.79230
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 4
• Exact Mass: 578.1667229
• Heavy Atom Count: 40
• Complexity: 994

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=NO)C)O)N)O.Cl
• Isomeric SMILES: CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(/C(=N/O)/C)O)N)O.Cl