chempirical

Dicofol

C14H9Cl5OCAS 115-32-2370.48 g/mol

Open in Covalent MOL file
OHClClClClCl
AlcoholAlkyl halideAryl halide

Properties

Molecular formula
C14H9Cl5O
Molar mass
370.48 g/mol
Exact mass
367.9096 Da
Density
1.13 g/mL (at 20 °C)
Melting point
77–78 °C
Boiling point
180 °C (at 0.1 Torr)
logP
5.60Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Identifiers

CAS number
115-32-2
SMILES
OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)C(Cl)(Cl)Cl
InChIKey
UOAMTSKGCBMZTC-UHFFFAOYSA-N
InChI
InChI=1S/C14H9Cl5O/c15-11-5-1-9(2-6-11)13(20,14(17,18)19)10-3-7-12(16)8-4-10/h1-8,20H

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

31 names · show all
  • Benzenemethanol, 4-chloro-α-(4-chlorophenyl)-α-(trichloromethyl)-
  • Benzhydrol, 4,4′-dichloro-α-(trichloromethyl)-
  • 4-Chloro-α-(4-chlorophenyl)-α-(trichloromethyl)benzenemethanol
  • ENT 23,648
  • 1,1-Bis(4-chlorophenyl)-2,2,2-trichloroethanol
  • 1,1-Bis(p-chlorophenyl)-2,2,2-trichloroethanol
  • CPCA
  • DTMC
  • FW 293
  • Kelthanethanol
  • 2,2,2-Trichloro-1,1-di(4-chlorophenyl)ethanol
  • Kelthane
  • Acarin
  • Mitigan
  • p,p′-Kelthane
  • Decofol
  • Ethanol, 2,2,2-trichloro-1,1-bis(4-chlorophenyl)-
  • Kelthane A
  • 2,2,2-Trichloro-1,1-bis(4-chlorophenyl)ethanol
  • 4,4′-Dichloro-α-(trichloromethyl)benzhydrol
  • Keltane
  • Dichlorokelthane
  • Milbol
  • 2,2,2-Trichloro-1,1-bis(p-chlorophenyl)ethanol
  • p,p′-Dicofol
  • Chloretanol
  • Agravertin
  • AFD 25
  • Colonel-S
  • Dacomain
  • Dicofol kelthene

Work with Dicofol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,1-Bis(4-chlorophenyl)ethanol80-06-854 % similar 4-Chlorobenzotrichloride5216-25-150 % similar 1-(4-Chlorophenyl)-1-phenylethanol59767-24-747 % similar 1-Chloro-4-(1,1-dimethylethyl)benzene3972-56-343 % similar Parachlorobenzotrifluoride98-56-643 % similar 4-(4-Chlorophenyl)-4-hydroxypiperidine39512-49-741 % similar 1,4-Dichlorobenzene106-46-741 % similar 1-(4-Chlorophenyl)cyclopropanecarboxylic acid72934-37-337 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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