Uridine-3'-(5-bromo-4-chloroindol-3-yl)-phosphate

Base Information

• Chemical Name: Uridine-3'-(5-bromo-4-chloroindol-3-yl)-phosphate
• CAS No.: 132900-87-9
• Molecular Formula: C33H51BrClN4O9P
• Molecular Weight: 794.110201
• DSSTox Substance ID: DTXSID00157846
• Mol file: 132900-87-9.mol

Synonyms:U-3'-BCIP;uridine-3'-(5-bromo-4-chloroindol-3-yl)-phosphate

Chemical Property of Uridine-3'-(5-bromo-4-chloroindol-3-yl)-phosphate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 189.00000
• Density: g/cm³
• LogP: 7.10310
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 18
• Exact Mass: 792.22656
• Heavy Atom Count: 49
• Complexity: 945

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC[N+](CCCC)(CCCC)CCCC.C1=CC(=C(C2=C1NC=C2OP(=O)([O-])OCC3C(C(C(O3)N4C=CC(=O)NC4=O)O)O)Cl)Br
• Isomeric SMILES: CCCC[N+](CCCC)(CCCC)CCCC.C1=CC(=C(C2=C1NC=C2OP(=O)([O-])OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=CC(=O)NC4=O)O)O)Cl)Br