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Substance Name: Triticonazole [ISO]
RN: 131983-72-7
UNII: C2O101E6G4
InChIKey: PPDBOQMNKNNODG-NTEUORMPSA-N

Note

  • A fungicide triticonazole.

Molecular Formula

  • C17-H20-Cl-N3-O

Molecular Weight

  • 317.818
 
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Names and Synonyms

Name of Substance

  • Triticonazole [ISO]

Synonyms

  • Alios
  • Charter
  • HSDB 7944
  • Premis
  • Premis 25 FS
  • Premis T
  • Premise
  • Triticonazole
  • UNII-C2O101E6G4

Systematic Name

  • Cyclopentanol, 5-4-chlorophenyl)methylene-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)-

Registry Numbers

CAS Registry Number

  • 131983-72-7

FDA UNII

  • C2O101E6G4

System Generated Number

  • 0131983727

Structure Descriptors

InChI

1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+

InChIKey

PPDBOQMNKNNODG-NTEUORMPSA-N

Smiles

CC1(C)CC\C(=C/c2ccc(Cl)cc2)\C1(O)Cn3cncn3

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 140 deg C   EXP
log P (octanol-water) 3.29 (none)   EXP
Water Solubility 7 mg/L 10 EXP
Atmospheric OH Rate Constant 9.40E-11 cm3/molecule-sec 25 EST

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