Chemical Properties of 3-(2,6-Dichlorophenyl)-5-methyl isoxazole-4-carbonyl chloride (CAS 4462-55-9)

3-(2,6-Dichlorophenyl)-5-methyl isoxazole-4-carbonyl chloride

InChI
InChI=1S/C11H6Cl3NO2/c1-5-8(11(14)16)10(15-17-5)9-6(12)3-2-4-7(9)13/h2-4H,1H3
InChI Key
IZQGELJKDARDMZ-UHFFFAOYSA-N
Formula
C11H6Cl3NO2
SMILES
Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)Cl
Molecular Weight1
290.53
CAS
4462-55-9
Other Names
  • Dcimc chloride
  • 4-Isoxazolecarbonyl chloride, 3-(2,6-dichlorophenyl)-5-methyl-
  • 3-(2,6-Dichlorophenyl)-5-methylisoxazole-4-carboxylic acid chloride
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Physical Properties

Property Value Unit Source
ω 0.6217 Relay (1.0) Calculated Property
ΔfG° -21.22 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -114.91 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 86.53 kJ/mol Relay (1.0) Calculated Property
IE 9.18 eV Relay (1.0) Calculated Property
log10WS -4.77 Relay (1.0) Calculated Property
logPoct/wat 4.336 Crippen Calculated Property
McVol 176.770 ml/mol McGowan Calculated Property
Pc 2849.15 kPa Relay (1.0-beta) Calculated Property
Tboil 602.68 K Relay (1.0) Calculated Property
Tc 889.88 K Relay (1.0) Calculated Property
Tfus 364.01 K Relay (1.0) Calculated Property
Vc 0.654 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

4-Isoxazolecarboxylic acid, 3-(o-chlorophenyl)-5-methyl-. 2-hydroxy-2-phenylethyl glucosinolate, TMS. Morazone. 7-[(2-hydroxy-2-phenylacetyl)amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid. Riboflavine. B-Pseudouridine riboside, TMS. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. Zinc octaethylporphyrin chloride. Cytosine arabinoside, dimethyl-allyldimethylsilyl derivative. Thymidine, 3'-O-acetyl, 5'-O-TBDMS. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. 1H-Indole-3-ethanol, 2-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-, [1S-(1«alpha»,2«alpha»,4«alpha»,5«beta»)]-. 2'-Deoxyguanosine, tris(trimethylsilyl) deriv.. Bicyclohexyl-1,1'-diol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane.

Find more compounds similar to 3-(2,6-Dichlorophenyl)-5-methyl isoxazole-4-carbonyl chloride.

Sources

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