Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 9-(3-Fluoro-2,3-dideoxy-beta-D-erythro-pentofuranosyl)adenine
RN: 87418-35-7
InChIKey: CTDUJDNZPPZTAV-RRKCRQDMSA-N

Molecular Formula

  • C10-H12-F-N5-O2

Molecular Weight

  • 253.2358
 
* 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

  • 3'-FddA (beta-D-Erythro)
  • 3'-FddAdo

Systematic Name

  • 9-(3-Fluoro-2,3-dideoxy-beta-D-erythro-pentofuranosyl)adenine

Registry Numbers

CAS Registry Number

  • 87418-35-7

System Generated Number

  • 0087418357

Structure Descriptors

InChI

1S/C10H12FN5O2/c11-5-1-7(18-6(5)2-17)16-4-15-8-9(12)13-3-14-10(8)16/h3-7,17H,1-2H2,(H2,12,13,14)/t5-,6+,7+/m0/s1

InChIKey

CTDUJDNZPPZTAV-RRKCRQDMSA-N

Smiles

c1nc(c2c(n1)n(cn2)[C@H]3C[C@@H]([C@H](O3)CO)F)N

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.08 (none)   EXP
Water Solubility 950 mg/L 25 EST
Vapor Pressure 4.20E-11 mm Hg 25 EST
Henry's Law Constant 1.66E-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.