4-Chloro-2-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-methylbenzenesulfonic acid
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![4-Chloro-2-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-methylbenzenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9f454e765fd94ef0befcc2929b43d9a7.png "4-Chloro-2-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-methylbenzenesulfonic acid")
4-Chloro-2-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-methylbenzenesulfonic acid
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CAS No:
84682-09-7
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Formula:
C17H15ClN4O7S2
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Chemical Name:
4-Chloro-2-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-methylbenzenesulfonic acid
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Synonyms:
Benzenesulfonic acid,4-chloro-2-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-methyl-;Benzenesulfonic acid,4-chloro-2-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]azo]-5-methyl-;4-Chloro-2-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-methylbenzenesulfonic acid
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CAS No:
4-Chloro-2-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-methylbenzenesulfonic acid Basic Attributes
486.90700
486.91
283-570-5
Computed Properties
Molecular Weight:486.9
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:5
Exact Mass:486.0070689
Monoisotopic Mass:486.0070689
Topological Polar Surface Area:183
Heavy Atom Count:31
Complexity:965
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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