TRANS-2-TERT-BUTYLCYCLOHEXAN-1-OL

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 9T74YJB0Y3

Structure

InChI Key DLTWBMHADAJAAZ-IUCAKERBSA-N
Smiles CC(C)(C)[C@H]1CCCC[C@@H]1O
InChI
InChI=1/C10H20O/c1-10(2,3)8-6-4-5-7-9(8)11/h8-9,11H,4-7H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H20O
Molecular Weight 156.15
AlogP 2.58
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Polar Surface Area 20.23
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 5448-22-6
NORMAN SUSDAT
FDA SRS 9T74YJB0Y3
CONTENTS