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Substance Name: N2-Acetylaciclovir
RN: 110104-37-5
UNII: G007Q63G24
InChIKey: DJMINGJGFGSDDB-UHFFFAOYSA-N

Molecular Weight

  • 267.2437
 
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Names and Synonyms

Name of Substance

  • N2-Acetylaciclovir

Synonyms

  • 9-((2-Hydroxyethoxy)methyl)-N2-acetylguanine
  • Acetamide, N-(6,9-dihydro-9-((2-hydroxyethoxy)methyl)-6-oxo-1H-purin-2-yl)-
  • Aciclovir impurity F [EP]
  • N2-Acetylaciclovir
  • UNII-G007Q63G24

Registry Numbers

CAS Registry Number

  • 110104-37-5

FDA UNII

  • G007Q63G24

System Generated Number

  • 0110104375

Structure Descriptors

InChI

1S/C10H13N5O4/c1-6(17)12-10-13-8-7(9(18)14-10)11-4-15(8)5-19-3-2-16/h4,16H,2-3,5H2,1H3,(H2,12,13,14,17,18)

InChIKey

DJMINGJGFGSDDB-UHFFFAOYSA-N

Smiles

CC(=O)Nc1[nH]c(=O)c2c(n1)n(cn2)COCCO

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 217 deg C   EXP
log P (octanol-water) -1.30E+00 (none)   EXP
Water Solubility 3220 mg/L 25 EXP
Vapor Pressure 3.62E-18 mm Hg 25 EST
Henry's Law Constant 1.63E-21 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.40E-11 cm3/molecule-sec 25 EST

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