rel-(1R,2S)-2-(2-Thienylcarbonyl)cyclohexanecarboxylic acid
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rel-(1R,2S)-2-(2-Thienylcarbonyl)cyclohexanecarboxylic acid
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CAS No:
212757-10-3
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Formula:
C12H14O3S
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Chemical Name:
rel-(1R,2S)-2-(2-Thienylcarbonyl)cyclohexanecarboxylic acid
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Synonyms:
Cyclohexanecarboxylic acid,2-(2-thienylcarbonyl)-,(1R,2S)-rel-;rel-(1R,2S)-2-(2-Thienylcarbonyl)cyclohexanecarboxylic acid;cis-2-(2-Thiophenecarbonyl)-1-cyclohexanecarboxylic acid
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CAS No:
Computed Properties
Molecular Weight:238.30
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:238.06636548
Monoisotopic Mass:238.06636548
Topological Polar Surface Area:82.6
Heavy Atom Count:16
Complexity:290
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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