ChemicalBook--->CAS DataBase List--->26518-76-3

26518-76-3

26518-76-3 Structure

26518-76-3 Structure
IdentificationBack Directory
[Name]

6-(CHLOROACETYL)-2H-1,4-BENZOXAZIN-3(4H)-ONE
[CAS]

26518-76-3
[Synonyms]

TIMTEC-BB SBB003321
6-(CHLOROACETYL)-2H-1,4-BENZOXAZIN-3(4H)-ONE
6-(2-Chloroacetyl)-2h-benzo[1,4]oxazin-3-one
6-(2-CHLOROACETYL)-2H-1,4-BENZOXAZIN-3(4H)-ONE
2H-1,4-Benzoxazin-3(4H)-one,6-(2-chloroacetyl)-
6-(Chloroacetyl)-2H-1,4-benzoxazin-3(4H)-one >
6-(2-CHLOROACETYL)-2H-BENZO[B][1,4]OXAZIN-3(4H)-ONE
6-(Chloroacetyl)-2H-1,4-benzoxazin-3(4H)-one
JR-8121, 6-(2-Chloroacetyl)-2H-benzo[b][1,4]oxazin-3(4H)-one, 97%
[Molecular Formula]

C10H8ClNO3
[MDL Number]

MFCD01321312
[MOL File]

26518-76-3.mol
[Molecular Weight]

225.63
Chemical PropertiesBack Directory
[Melting point ]

228-230 °C(lit.)
[Boiling point ]

472.9±45.0 °C(Predicted)
[density ]

1.386
[form ]

powder to crystal
[pka]

11.93±0.20(Predicted)
[color ]

White to Light yellow
[InChI]

1S/C10H8ClNO3/c11-4-8(13)6-1-2-9-7(3-6)12-10(14)5-15-9/h1-3H,4-5H2,(H,12,14)
[InChIKey]

MIAHXWVABDHISZ-UHFFFAOYSA-N
[SMILES]

ClCC(=O)c1ccc2OCC(=O)Nc2c1
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[HS Code ]

2934999090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

6-(Chloroacetyl)-2H-1,4-benzoxazin-3(4H)-one may be used in the preparation of [2-(3-oxo-3,4-dihydro-2H-benzo[1,4]oxazin-6-carbonyl)-1H-indol-3-yl]acetic acids and N-alkyl 6-[2-(4,6-diphenylpyridyl)]-2H-[1,4]benzoxazin-3-one.
[General Description]

6-(Chloroacetyl)-2H-1,4-benzoxazin-3(4H)-one is a heterocyclic building block.
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