Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 9H-Purin-6-amine, 9-(2,3-dideoxy-2-fluoro-beta-D-threo-pentofuranosyl)-2-methyl-
RN: 132722-91-9
InChIKey: VLWUFDZACUOMPE-OKTBNZSVSA-N

Molecular Formula

  • C11-H14-F-N5-O2

Molecular Weight

  • 267.2626
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 2'-F-2-Me-ddA
  • 9-(2,3-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)-2-methyladenine

Systematic Name

  • 9H-Purin-6-amine, 9-(2,3-dideoxy-2-fluoro-beta-D-threo-pentofuranosyl)-2-methyl-

Registry Numbers

CAS Registry Number

  • 132722-91-9

System Generated Number

  • 0132722919

Structure Descriptors

InChI

1S/C11H14FN5O2/c1-5-15-9(13)8-10(16-5)17(4-14-8)11-7(12)2-6(3-18)19-11/h4,6-7,11,18H,2-3H2,1H3,(H2,13,15,16)/t6-,7-,11+/m0/s1

InChIKey

VLWUFDZACUOMPE-OKTBNZSVSA-N

Smiles

Cc1nc(c2c(n1)n(cn2)[C@H]3[C@H](C[C@H](O3)CO)F)N

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.12 (none)   EXP
Water Solubility 732 mg/L 25 EST
Vapor Pressure 1.62E-11 mm Hg 25 EST
Henry's Law Constant 1.83E-19 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.08E-10 cm3/molecule-sec 25 EST

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