3-Chloro-2,4-hexadienedioic acid
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3-Chloro-2,4-hexadienedioic acid
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CAS No:
20665-95-6
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Formula:
C6H5ClO4
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Chemical Name:
3-Chloro-2,4-hexadienedioic acid
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Synonyms:
2,4-Hexadienedioic acid,3-chloro-;Muconic acid,3-chloro-;3-Chloro-2,4-hexadienedioic acid;β-Chloromuconic acid;3-Chloromuconic acid;3-Chloro-hexa-2,4-dienedioic acid
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CAS No:
Computed Properties
Molecular Weight:176.55
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:175.9876363
Monoisotopic Mass:175.9876363
Topological Polar Surface Area:74.6
Heavy Atom Count:11
Complexity:229
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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