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4-(4-Chloro-3-nitrophenyl)-3-methyl-4-oxobutanoic acid
[CAS# 85633-96-1]

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Identification
Name 4-(4-Chloro-3-nitrophenyl)-3-methyl-4-oxobutanoic acid
Synonyms MFCD02211210; BIM-0035830.P001; CBMicro_035758
Molecular Structure CAS#: 85633-96-1, 4-(4-Chloro-3-nitrophenyl)-3-methyl-4-oxobutanoic acid
Molecular Formula C11H10ClNO5
Molecular Weight 271.65
CAS Registry Number 85633-96-1
SMILES CC(CC(=O)O)C(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]
InChI 1S/C11H10ClNO5/c1-6(4-10(14)15)11(16)7-2-3-8(12)9(5-7)13(17)18/h2-3,5-6H,4H2,1H3,(H,14,15)
InChIKey ZDGKTISONWFCDF-UHFFFAOYSA-N
Properties
Density 1.4±0.1g/cm3 (Cal.)
Boiling point 447.2±35.0°C at 760 mmHg (Cal.)
Flash point 224.3±25.9°C (Cal.)
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List of Reports Available for 4-(4-Chloro-3-nitrophenyl)-3-methyl-4-oxobutanoic acid
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