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Substance Name: 2-Amino-6-bromo-9-(2,3-dideoxy-beta-D-glycero-pentofuranosyl)-9H-purine
RN: 132194-22-0
InChIKey: WXINSBSCFDVBBO-NTSWFWBYSA-N

Molecular Formula

  • C10-H12-Br-N5-O2

Molecular Weight

  • 314.1418
 
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Names and Synonyms

Synonyms

  • 2-Amino-6-bromo-ddP
  • 2-NH2-6Br-ddP

Systematic Name

  • 2-Amino-6-bromo-9-(2,3-dideoxy-beta-D-glycero-pentofuranosyl)-9H-purine

Registry Numbers

CAS Registry Number

  • 132194-22-0

System Generated Number

  • 0132194220

Structure Descriptors

InChI

1S/C10H12BrN5O2/c11-8-7-9(15-10(12)14-8)16(4-13-7)6-2-1-5(3-17)18-6/h4-6,17H,1-3H2,(H2,12,14,15)/t5-,6+/m0/s1

InChIKey

WXINSBSCFDVBBO-NTSWFWBYSA-N

Smiles

c1nc2c(n1[C@H]3CC[C@H](O3)CO)nc(nc2Br)N

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.34 (none)   EXP
Water Solubility 306 mg/L 25 EST
Vapor Pressure 9.24E-11 mm Hg 25 EST
Henry's Law Constant 9.38E-17 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.72E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.