rel-(1R,2S)-3,5-Cyclohexadiene-1,2-diol
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rel-(1R,2S)-3,5-Cyclohexadiene-1,2-diol
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CAS No:
17793-95-2
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Formula:
C6H8O2
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Chemical Name:
rel-(1R,2S)-3,5-Cyclohexadiene-1,2-diol
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Synonyms:
3,5-Cyclohexadiene-1,2-diol,(1R,2S)-rel-;3,5-Cyclohexadiene-1,2-diol,cis-;rel-(1R,2S)-3,5-Cyclohexadiene-1,2-diol;cis-3,5-Cyclohexadiene-1,2-diol;cis-1,2-Dihydroxycyclohexa-3,5-diene;5,6-cis-Dihydroxycyclohexa-1,3-diene;cis-1,2-Dihydrocatechol;194159-55-2
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CAS No:
Description
Cis-cyclohexa-3,5-diene-1,2-diol is the cis-stereoisomer of cyclohexa-3,5-diene-1,2-diol.
Characteristics
40.5
-0.32
0.904 g/mL at 25 °C
60 °C @ Solvent: Hexane
226.4±28.0 °C(Predicted)
-3 °C
n20/D 1.403
−20°C
Computed Properties
Molecular Weight:112.13
XLogP3:-0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:112.052429494
Monoisotopic Mass:112.052429494
Topological Polar Surface Area:40.5
Heavy Atom Count:8
Complexity:111
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
rel-(1R,2S)-3,5-Cyclohexadiene-1,2-diol
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