ChemSpider 2D Image | 3'-O-(4-{[(E)-2-Chlorovinyl](methyl)amino}phenyl)-5'-O-(dimethoxyphosphoryl)uridine | C20H25ClN3O9P

3'-O-(4-{[(E)-2-Chlorovinyl](methyl)amino}phenyl)-5'-O-(dimethoxyphosphoryl)uridine

  • Molecular FormulaC20H25ClN3O9P
  • Average mass517.854 Da
  • Monoisotopic mass517.101685 Da
  • ChemSpider ID4948135

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3'-O-(4-{[(E)-2-Chlorovinyl](methyl)amino}phenyl)-5'-O-(dimethoxyphosphoryl)uridine [ACD/IUPAC Name]
3'-O-(4-{[(E)-2-Chlorovinyl](méthyl)amino}phényl)-5'-O-(diméthoxyphosphoryl)uridine [French] [ACD/IUPAC Name]
3'-O-(4-{[(E)-2-Chlorvinyl](methyl)amino}phenyl)-5'-O-(dimethoxyphosphoryl)uridin [German] [ACD/IUPAC Name]
Uridine, 3'-O-[4-[[(E)-2-chloroethenyl]methylamino]phenyl]-5'-O-(dimethoxyphosphinyl)- [ACD/Index Name]
2',3'-(O)-(4-(N-2-Chloroethyl-N-methylamino)benzylidene)uridine-5'-methylphosphate
2',3'-O-(4-(N-2-Chloroethyl-N-methylamino)-benzylidine)-uridine-5'-methylphosphate
25878-32-4 [RN]
5'-Uridylic acid, 2',3'-O-((4-((2-chloroethyl)methyl)amino)phenyl)methylene)-, monomethyl ester
Uridine, 2',3'-O-(p-((2-chloroethyl)methylamino)benzylidene)-, 5'-(methyl hydrogenphosphate)

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

BRN 0905797 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.595
Molar Refractivity: 121.1±0.3 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: -1.45
ACD/LogD (pH 5.5): -0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.03
ACD/LogD (pH 7.4): -0.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 18.81
Polar Surface Area: 146 Å2
Polarizability: 48.0±0.5 10-24cm3
Surface Tension: 59.7±3.0 dyne/cm
Molar Volume: 356.5±3.0 cm3

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