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Home> Hot Product Listed 2   > 2,4(1H,3H)-Pyrimidinedione,1-b-D-arabinofuranosyl-5-[(1E)-2-bromoethenyl]-
18636-87-8 structure

2,4(1H,3H)-Pyrimidinedione,1-b-D-arabinofuranosyl-5-[(1E)-2-bromoethenyl]-

Iupac Name:12-oxidobenzo[a]phenazin-12-ium
CAS No.:18636-87-8
Molecular Weight:246.269
Molecular Formula:C12H17CL2NO2 (isomer)
Names and Identifiers
Synonyms

(E)-5-(2-Bromovinyl)-1-(b-D-arabinofuranosyl)uracil 1-b-D-Arabinofuranosyl-(E)-5-(2-bromovinyl)uracil 1-b-D-Arabinofuranosyl-5-(2-bromovinyl)uracil 2,4(1H,3H)-Pyrimidinedione,1-b-D-arabinofuranosyl-5-(2-bromoethenyl)-,(E)- 5-Bromovinyl-araU Arabinosyl (E)-5-(2-bromovinyl)uracil Bravavir Brovavir BVaraU BVAU Sorivudine SQ 32756 Usevir YN 72

Inchi
InChI=1S/C16H10N2O/c19-18-15-8-4-3-7-13(15)17-14-10-9-11-5-1-2-6-12(11)16(14)18/h1-10H
InChkey
QOEUHFSHKLIUGS-UHFFFAOYSA-N
Canonical Smiles
C1=CC=C2C(=C1)C=CC3=NC4=CC=CC=C4[N+](=C32)[O-]
Properties
Density
1.337
Boiling Point
216.7ºC at 760mmHg
Vapour
1.34E-09mmHg at 25°C
Refractive Index
1.711
Flash Point
113.5°C
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:246.269g/mol
  • Molecular Formula:C12H17CL2NO2
  • Compound Is Canonicalized:True
  • Exact Mass:246.079
  • Monoisotopic Mass:246.079
  • Complexity:335
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Heavy Atom Count:19
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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