2-Butyl-1,3-benzenedicarboxylic acid
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2-Butyl-1,3-benzenedicarboxylic acid
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CAS No:
5293-56-1
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Formula:
C12H14O4
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Chemical Name:
2-Butyl-1,3-benzenedicarboxylic acid
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Synonyms:
1,3-Benzenedicarboxylic acid,2-butyl-;Isophthalic acid,2-butyl-;2-Butyl-1,3-benzenedicarboxylic acid;2-n-Butylisophthalic acid;2-Butylisophthalic acid
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CAS No:
Computed Properties
Molecular Weight:222.24
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:222.08920892
Monoisotopic Mass:222.08920892
Topological Polar Surface Area:74.6
Heavy Atom Count:16
Complexity:240
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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