rel-3-[(3R,4S)-1,3-Dimethyl-4-propyl-4-piperidinyl]phenol
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![rel-3-[(3R,4S)-1,3-Dimethyl-4-propyl-4-piperidinyl]phenol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7f03e14a32f04cf58511651318709faa.png "rel-3-[(3R,4S)-1,3-Dimethyl-4-propyl-4-piperidinyl]phenol")
rel-3-[(3R,4S)-1,3-Dimethyl-4-propyl-4-piperidinyl]phenol
structure -
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CAS No:
79201-85-7
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Formula:
C16H25NO
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Chemical Name:
rel-3-[(3R,4S)-1,3-Dimethyl-4-propyl-4-piperidinyl]phenol
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Synonyms:
Phenol,3-[(3R,4S)-1,3-dimethyl-4-propyl-4-piperidinyl]-,rel-;Phenol,3-(1,3-dimethyl-4-propyl-4-piperidinyl)-,trans-(±)-;rel-3-[(3R,4S)-1,3-Dimethyl-4-propyl-4-piperidinyl]phenol;LY 150720;Picenadol;(±)-Picenadol;Phenol,3-(1,3-dimethyl-4-propyl-4-piperidinyl)-,trans-;117821-98-4
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CAS No:
Computed Properties
Molecular Weight:247.38
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:247.193614421
Monoisotopic Mass:247.193614421
Topological Polar Surface Area:23.5
Heavy Atom Count:18
Complexity:268
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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