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Home> Hot Product Listed M   > Methanone,(4-chlorophenyl)(2,4,5-trichloro-1H-imidazol-1-yl)-
57069-86-0 structure

Methanone,(4-chlorophenyl)(2,4,5-trichloro-1H-imidazol-1-yl)-

Iupac Name:4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)butan-2-ol
CAS No.:57069-86-0
EINECS(EC#): 299-923-1
Molecular Weight:194.31318
Molecular Formula: (isomer)
Names and Identifiers
Synonyms

(4-chlorophenyl)-(2,4,5-trichloroimidazol-1-yl)methanone 1h-imidazole, 2,4,5-trichloro-1-(4-chlorobenzoyl)- 1H-Imidazole,2,4,5-trichloro-1-(4-chlorobenzoyl)- (9CI) 2,4,5-trichloro-1-(4-chlorobenzoyl)-1h-imidazole 2,4,5-trichloro-1-(4-chlorobenzoyl)imidazole AC1L4CDZ DTXSID70149516 HE295626

Inchi
InChI=1/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-6,11,14H,7-9H2,1-4H3
Canonical Smiles
CC1=C(C(CC=C1)(C)C)CCC(C)O
Properties
Density
1.23
Refractive Index
1.476
Flash Point
317.1°C
Computational chemical data
  • Molecular Weight:194.31318g/mol
  • Molecular Formula:
  • Exact Mass:194.167065
  • Monoisotopic Mass:194.167065
  • Complexity:258
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:20.2
  • Heavy Atom Count:14
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:1
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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