Chemical Properties of 1H-1,2,4-Triazole, 1-[2-(2,4-dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]- (CAS 112281-77-3)

1H-1,2,4-Triazole, 1-[2-(2,4-dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-

InChI
InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2
InChI Key
LQDARGUHUSPFNL-UHFFFAOYSA-N
Formula
C13H11Cl2F4N3O
SMILES
FC(F)C(F)(F)OCC(Cn1cncn1)c1ccc(Cl)cc1Cl
Molecular Weight1
372.15
CAS
112281-77-3
Other Names
  • 1-[2-(2,4-Dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-1,2,4-triazole
  • TETRACONAZOLE
  • Tetraconazol
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
logPoct/wat 4.243 Crippen Calculated Property
McVol 218.180 ml/mol McGowan Calculated Property
Inp [1998.00; 2013.00]   Show Hide
Inp 2013.00 NIST
Inp 1998.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Benzquinamide M (N-des-Et), acetylated. 3-O,6-O,N-Triacetylnormorphine. Benzylmorphine. (1,S,2S,3R,5S)-(+)-Pinanediol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Ethylmorphine, trimethylsilyl ether. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Nicocodine. morphine. Norcodeine. Methyldesorphine. QUINIDINE, M(HO-), AC. ERGOTAMINE. Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). DIHYDROERGOKRYPTINE. BUPRENORPHINE.

Find more compounds similar to 1H-1,2,4-Triazole, 1-[2-(2,4-dichlorophenyl)-3-(1,1,2,2-tetrafluoroethoxy)propyl]-.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.