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α-Cyclohexyl-2-naphthalenemethanol

CAT: 0127-OR1086256-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1086256-01Size:250 mg
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CAS Number
186407-83-0
MDL Number
MFCD06654251
Purity
95%
Smiles
C (O) (c1cc2c (cc1) cccc2) C1CCCCC1

Chemical Information

alpha-Cyclohexyl-2-naphthalenemethanol
CAS Number186407-83-0
PubChem CID2793933
IUPAC Namecyclohexyl(naphthalen-2-yl)methanol
Molecular FormulaC17H20O
Molecular Weight240.34
XLogP4.7
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity256
SMILES
C1CCC(CC1)C(C2=CC3=CC=CC=C3C=C2)O
InChI
InChI=1S/C17H20O/c18-17(14-7-2-1-3-8-14)16-11-10-13-6-4-5-9-15(13)12-16/h4-6,9-12,14,17-18H,1-3,7-8H2
InChIKey
DEDUKDRLNKYYOK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of alpha-Cyclohexyl-2-naphthalenemethanol
CAS: 186407-83-0
CID: 2793933
Formula: C17H20O
MW: 240.34
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight240.34
XLogP34.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass240.151415257
Monoisotopic Mass240.151415257
Topological Polar Surface Area20.2 Ų
Heavy Atom Count18
Formal Charge0
Complexity256
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes