ChemicalBook--->CAS DataBase List--->62348-13-4

62348-13-4

62348-13-4 Structure

62348-13-4 Structure
IdentificationMore
[Name]

ISOXAZOLE-5-CARBONYL CHLORIDE
[CAS]

62348-13-4
[Synonyms]

5-ISOXAZOLECARBONYL CHLORIDE
BUTTPARK 27\08-42
ISOXAZOLE-5-CARBONYL CHLORIDE
TIMTEC-BB SBB005469
Isoxazole-5-carbonylchloride,97%
5-Isoxazolecarbonyl chloride (9CI)
Isoxazole-5-carbonyl chloride 97%
Isoxazole-5-carbonyl chloride, GC 97%
ISOXAZOLE-5-CARBONYCHLORIDE
[EINECS(EC#)]

627-743-9
[Molecular Formula]

C4H2ClNO2
[MDL Number]

MFCD00067868
[Molecular Weight]

131.52
[MOL File]

62348-13-4.mol
Chemical PropertiesBack Directory
[Boiling point ]

167-168 °C(lit.)
[density ]

1.362 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.4980(lit.)
[Fp ]

190 °F
[storage temp. ]

Store under Nitrogen
[form ]

liquid
[pka]

-4.58±0.50(Predicted)
[color ]

Brown
[Sensitive ]

Moisture Sensitive
[BRN ]

4375023
[InChI]

1S/C4H2ClNO2/c5-4(7)3-1-2-6-8-3/h1-2H
[InChIKey]

NASLINFISOTVJJ-UHFFFAOYSA-N
[SMILES]

ClC(=O)c1ccno1
[CAS DataBase Reference]

62348-13-4(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

R34:Causes burns.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 3265 8/PG 2
[WGK Germany ]

3
[Hazard Note ]

Harmful/Corrosive/Moisture Sensitive
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

2934999090
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Eye Dam. 1
Skin Corr. 1B
Hazard InformationBack Directory
[Uses]

Isoxazole-5-carbonyl chloride can undergo reaction with 1-benzhydrylpiperazine to give the corresponding 1-benzhydrylpiperazine derivative, which may be used in the treatment of cancer. It can also be used in the synthesis of N-Isoxazole-5-carbonyl-1,3-diphenyl-5-amino-1H-pyrazole, which can act like potent agent in the treatment of neurological and psychiatric illness.
Spectrum DetailBack Directory
[Spectrum Detail]

ISOXAZOLE-5-CARBONYL CHLORIDE(62348-13-4)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Isoxazole-5-carbonyl chloride, 90%(62348-13-4)
[Alfa Aesar]

Isoxazole-5-carbonyl chloride, 97%(62348-13-4)
[Sigma Aldrich]

62348-13-4(sigmaaldrich)
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