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Substance Name: 4-Cinnolinyl methyl ether
RN: 3397-78-2
UNII: QEG2E1A01C
InChIKey: XVPKWOIIQKBTFD-UHFFFAOYSA-N

Molecular Formula

  • C9-H8-N2-O

Molecular Weight

  • 160.1752
 
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Names and Synonyms

Name of Substance

  • 4-Cinnolinyl methyl ether

Synonyms

  • NSC 158309
  • UNII-QEG2E1A01C

Systematic Name

  • 4-Cinnolinyl methyl ether

Registry Numbers

CAS Registry Number

  • 3397-78-2

FDA UNII

  • QEG2E1A01C

System Generated Number

  • 0003397782

Structure Descriptors

InChI

1S/C9H8N2O/c1-12-9-6-10-11-8-5-3-2-4-7(8)9/h2-6H,1H3

InChIKey

XVPKWOIIQKBTFD-UHFFFAOYSA-N

Smiles

COc1cnnc2c1cccc2

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.41 (none)   EXP
Water Solubility 4270 mg/L 25 EST
Vapor Pressure 6.78E-05 mm Hg 25 EST
Henry's Law Constant 1.66E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.29E-11 cm3/molecule-sec 25 EST

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