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(-) -8-Phenylmenthol

CAT: 0024-sc-239130ASize: 150 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-239130ASize:150 mg
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CAS Number
65253-04-5

Chemical Information

(-)-8-Phenylmenthol
CAS Number65253-04-5
PubChem CID2725001
IUPAC Name(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexan-1-ol
Molecular FormulaC16H24O
Molecular Weight232.36
XLogP4.5
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity240
SMILES
C[C@@H]1CC[C@H]([C@@H](C1)O)C(C)(C)C2=CC=CC=C2
InChI
InChI=1S/C16H24O/c1-12-9-10-14(15(17)11-12)16(2,3)13-7-5-4-6-8-13/h4-8,12,14-15,17H,9-11H2,1-3H3/t12-,14-,15-/m1/s1
InChIKey
WTQIZFCJMGWUGZ-BPLDGKMQSA-N
Chemical Structure
2D Structure
2D structure of (-)-8-Phenylmenthol
CAS: 65253-04-5
CID: 2725001
Formula: C16H24O
MW: 232.36
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight232.36
XLogP34.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass232.182715385
Monoisotopic Mass232.182715385
Topological Polar Surface Area20.2 Ų
Heavy Atom Count17
Formal Charge0
Complexity240
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes