ChemicalBook--->CAS DataBase List--->81282-12-4

81282-12-4

81282-12-4 Structure

81282-12-4 Structure
IdentificationBack Directory
[Name]

ETHYL 5-(4-CHLOROPHENYL)ISOXAZOLE-3-CARBOXYLATE
[CAS]

81282-12-4
[Synonyms]

ETHYL 5-(4-CHLOROPHENYL)ISOXAZOLE-3-CARBOXYLATE
3-(4-Chloro-phenyl)-isoxazole-5-carboxylic acid ethylester
5-(4-chloro-phenyl)-isoxazole-3-carboxylic acid ethyl ester
3-Isoxazolecarboxylic acid, 5-(4-chlorophenyl)-, ethyl ester
[Molecular Formula]

C12H10ClNO3
[MDL Number]

MFCD08446403
[MOL File]

81282-12-4.mol
[Molecular Weight]

251.67
Chemical PropertiesBack Directory
[Melting point ]

127-128 °C(Solv: ethanol (64-17-5))
[Boiling point ]

405.4±35.0 °C(Predicted)
[density ]

1.276±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

solid
[pka]

-6.61±0.38(Predicted)
[InChI]

1S/C12H10ClNO3/c1-2-16-12(15)10-7-11(17-14-10)8-3-5-9(13)6-4-8/h3-7H,2H2,1H3
[InChIKey]

CJQWCZKLLDAKCX-UHFFFAOYSA-N
[SMILES]

CCOC(=O)c1cc(on1)-c2ccc(Cl)cc2
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36
[Safety Statements ]

26
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
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