3,5-Cyclohexadiene-1,2-diol, 3-ethynyl-, (1S,2R)- (9CI)
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3,5-Cyclohexadiene-1,2-diol, 3-ethynyl-, (1S,2R)- (9CI)
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CAS No:
114763-29-0
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Formula:
C8H8O2
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Chemical Name:
3,5-Cyclohexadiene-1,2-diol, 3-ethynyl-, (1S,2R)- (9CI)
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Synonyms:
3,5-Cyclohexadiene-1,2-diol, 3-ethynyl-, (1S,2R)- (9CI)
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CAS No:
Computed Properties
Molecular Weight:136.15
XLogP3:-0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:136.052429494
Monoisotopic Mass:136.052429494
Topological Polar Surface Area:40.5
Heavy Atom Count:10
Complexity:229
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3,5-Cyclohexadiene-1,2-diol, 3-ethynyl-, (1S,2R)- (9CI)
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