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Substance Name: 4-Hydroxyclonidine
RN: 57101-48-1
InChIKey: NTWBRPXHGAXREI-UHFFFAOYSA-N

Molecular Formula

  • C9-H9-Cl2-N3-O

Molecular Weight

  • 246.096
 
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Names and Synonyms

Name of Substance

  • 4-Hydroxyclonidine

Synonym

  • para-Hydroxyclonidine

Systematic Name

  • Phenol, 3,5-dichloro-4-((4,5-dihydro-1H-imidazol-2-yl)amino)-

Registry Numbers

CAS Registry Number

  • 57101-48-1

System Generated Number

  • 0057101481

Structure Descriptors

InChI

1S/C9H9Cl2N3O/c10-6-3-5(15)4-7(11)8(6)14-9-12-1-2-13-9/h3-4,15H,1-2H2,(H2,12,13,14)

InChIKey

NTWBRPXHGAXREI-UHFFFAOYSA-N

Smiles

c1(NC2=NCCN2)c(cc(cc1Cl)O)Cl

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.52 (none)   EXP
Water Solubility 4.85E+04 mg/L 25 EST
Vapor Pressure 3.44E-07 mm Hg 25 EST
Henry's Law Constant 1.57E-15 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.58E-10 cm3/molecule-sec 25 EST

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