Ara-cdp-dipalmitin

Base Information

• Chemical Name: Ara-cdp-dipalmitin
• CAS No.: 63357-80-2
• Molecular Formula: C44H81 N3 O15 P2
• Molecular Weight: 954.07
• DSSTox Substance ID: DTXSID60979501
• ChEMBL ID: CHEMBL3350492
• Mol file: 63357-80-2.mol

Synonyms:1 beta-D-arabinofuranosylcytosine 5'-diphosphate-L-1,2 dipalmitin;ARA-CDP-dipalmitin

Chemical Property of Ara-cdp-dipalmitin

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 951.6°C at 760 mmHg
• Flash Point: 529.3°C
• PSA: 285.11000
• Density: 1.27g/cm³
• LogP: 9.69410
• XLogP3: 9.7
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 15
• Rotatable Bond Count: 42
• Exact Mass: 953.51429288
• Heavy Atom Count: 64
• Complexity: 1470

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)O)O)OC(=O)CCCCCCCCCCCCCCC
• Isomeric SMILES: CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@@H]([C@@H](O1)N2C=CC(=NC2=O)N)O)O)OC(=O)CCCCCCCCCCCCCCC