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Diss Factsheets

Reference substances

Reference substances

IUPAC name:
3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl chloride

Inventory

EC number:
247-137-4
EC name:
3-(2-chlorophenyl)-5-methylisoxazole-4-carbonyl chloride
CAS number:
25629-50-9
CAS number:
25629-50-9
Synonyms
Names:
3-(2-chlorophenyl)-5-methylisoxazole-4-carbonyl_chloride
4-Isoxazolecarbonyl chloride, 3-(2-chlorophenyl)-5-methyl-
Identifier:
IUPAC name
3-(2-chlorophenyl)-5-methylisoxazole-4-carbonyl chloride
Identifier:
other: SMILES notation
CC1=C(C(=O)Cl)C(c2ccccc2Cl)=NO1
Identifier:
other: SMILES notation
Cc1onc(c2ccccc2Cl)c1C(=O)Cl
Identifier:
other: InChl
InChI=1/C11H7Cl2NO2/c1-6-9(11(13)15)10(14-16-6)7-4-2-3-5-8(7)12/h2-5H,1H3
3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl chloride

Molecular and structural information

Molecular formula:
C11H7Cl2NO2
Molecular weight:
256.087
SMILES notation:
c1(c(c(C)on1)C(=O)Cl)c1c(Cl)cccc1
InChl:
1S/C11H7Cl2NO2/c1-6-9(11(13)15)10(14-16-6)7-4-2-3-5-8(7)12/h2-5H,1H3
Structural formula:
Chemical structure

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