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Substance Name: 2'-Fluoro-2',3'-dideoxyadenosine
RN: 110143-05-0
InChIKey: KBEMFSMODRNJHE-BAJZRUMYSA-N

Molecular Formula

  • C10-H12-F-N5-O2

Molecular Weight

  • 253.236
 
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Names and Synonyms

Name of Substance

  • 2'-Fluoro-2',3'-dideoxyadenosine

Synonym

  • 2',3'-Dideoxy-2'-fluoroadenosine

Systematic Name

  • Adenosine, 2',3'-dideoxy-2'-fluoro-

Registry Numbers

CAS Registry Number

  • 110143-05-0

System Generated Number

  • 0110143050

Structure Descriptors

InChI

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

InChIKey

KBEMFSMODRNJHE-BAJZRUMYSA-N

Smiles

n1(c2c(c(N)ncn2)nc1)[C@@H]1O[C@H](CO)C[C@H]1F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo oral 2gm/kg (2000mg/kg) CARDIAC: OTHER CHANGES Toxicologist. Vol. 12, Pg. 155, 1992.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -0.14 (none)   EXP
Water Solubility 1580 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 2.07E-10 cm3/molecule-sec 25 EST

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