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Substance Name: 6-Iodo-9-(2,3-dideoxy-beta-D-glycero-pentofuranosyl)-9H-purine
RN: 120503-37-9
InChIKey: OAVOLNUBQURQIX-NKWVEPMBSA-N

Molecular Formula

  • C10-H11-I-N4-O2

Molecular Weight

  • 346.1229
 
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Names and Synonyms

Synonyms

  • 6-I-ddP
  • 6-Iodo-ddP

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 120503-37-9

System Generated Number

  • 0120503379

Structure Descriptors

InChI

1S/C10H11IN4O2/c11-9-8-10(13-4-12-9)15(5-14-8)7-2-1-6(3-16)17-7/h4-7,16H,1-3H2/t6-,7+/m0/s1

InChIKey

OAVOLNUBQURQIX-NKWVEPMBSA-N

Smiles

c1nc2c(c(n1)I)ncn2[C@H]3CC[C@H](O3)CO

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.53 (none)   EXP
Water Solubility 2310 mg/L 25 EST
Vapor Pressure 2.07E-11 mm Hg 25 EST
Henry's Law Constant 5.46E-17 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.05E-11 cm3/molecule-sec 25 EST

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