Chemical Properties of Oxadiazon (CAS 19666-30-9)

InChI

InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3

InChI Key

CHNUNORXWHYHNE-UHFFFAOYSA-N

Formula

C15H18Cl2N2O3

SMILES

CC(C)Oc1cc(-n2nc(C(C)(C)C)oc2=O)c(Cl)cc1Cl

Molecular Weight¹

345.22

CAS

19666-30-9

Other Names

• 1,3,4-Oxadiazol-2(3H)-one, 3-[2,4-dichloro-5-(1-methylethoxy)phenyl]-5-(1,1-dimethylethyl)-
• 1,3,4-Oxazol-2(3H)-one, 3-(2,4-dichloro-5-(1-methylethoxy)phenyl)-5-(1,1-dimethylethyl)-
• 17623 RP
• 2-tert-Butyl-4-(2,4-dichloro-5-isopropyloxyphenyl)-1,3,4-oxadiazolin-5-one
• 3-(2,4-Dichloro-5-isopropyloxy-phenyl)-«delta»4-5-(tert-butyl)-1,3,4-oxadiazoline-2-one
• 3-[2,4-Dichloro-5-(1-methylethoxy)phenyl]-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-one
• 5-tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one
• G 315
• Oxadiazone
• Oxydiazon
• RP 17,623
• RP 17623
• Ronstar
• Ronstar 50W
• Scotts OH I
• «DELTA»2-1,3,4-Oxadiazolin-5-one, 2-tert-butyl-4-(2,4-dichloro-5-isopropoxyphenyl)-
• «DELTA»2-1,3,4-Oxadiazolin-5-one, 2-tert-butyl-4-(2,4-dichloro-5-isopropyloxyphenyl)-

• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	[-5.70; -5.69]
log10WS	-5.69		Aq. Solubility Prediction
log10WS	-5.70		Estimated Solubility
logPoct/wat	4.217		Crippen Calculated Property
McVol	241.040	ml/mol	McGowan Calculated Property
Inp	[2138.00; 2200.00]
Inp	2159.00		NIST
Inp	2200.00		NIST
Inp	2182.00		NIST
Inp	2186.00		NIST
Inp	2182.00		NIST
Inp	2189.00		NIST
Inp	2198.00		NIST
Inp	2189.00		NIST
Inp	2187.00		NIST
Inp	2182.00		NIST
Inp	Outlier 2138.00		NIST
Inp	2189.00		NIST
Inp	2182.00		NIST
I	2948.00		NIST
Tfus	361.25 ± 0.20	K	NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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 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.

Temperature Dependent Properties

Similar Compounds

Find more compounds similar to Oxadiazon.

Sources

• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Aqueous Solubility Prediction Method
• Estimated Solubility Method
• McGowan Method
• NIST Webbook

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.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
These property values are available through the Cheméo API. A free account gives you an access key.