4-((2,4-DICHLOROPHENYL)METHYLENE)-3-(TERT-BUTYL)-1-(4-NITROPHENYL)-2-PYRAZOLIN-5-ONE
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4-((2,4-DICHLOROPHENYL)METHYLENE)-3-(TERT-BUTYL)-1-(4-NITROPHENYL)-2-PYRAZOLIN-5-ONE
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CAS No:
1025673-99-7
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Formula:
C20H17Cl2N3O3
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Chemical Name:
4-((2,4-DICHLOROPHENYL)METHYLENE)-3-(TERT-BUTYL)-1-(4-NITROPHENYL)-2-PYRAZOLIN-5-ONE
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Synonyms:
(4Z)-3-tert-butyl-4-[(2,4-dichlorophenyl)methylidene]-1-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-5-one;ZINC33697120;AKOS005109743;MS-8032
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CAS No:
4-((2,4-DICHLOROPHENYL)METHYLENE)-3-(TERT-BUTYL)-1-(4-NITROPHENYL)-2-PYRAZOLIN-5-ONE Basic Attributes
418.27
417.065
Computed Properties
Molecular Weight:418.3
XLogP3:5.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:417.0646968
Monoisotopic Mass:417.0646968
Topological Polar Surface Area:78.5
Heavy Atom Count:28
Complexity:688
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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