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1,3,5-Triphenylcyclohexane

CAT: 1596-AR-M05357-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-M05357-01Size:10 Units
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CAS Number
28336-57-4
Synonyms
(3,5-diphenylcyclohexyl) benzene
Molecular Formula
C24H24
Molecular Weight
312.46
API Name
Miscellaneous

Chemical Information

1,3,5-Triphenylcyclohexane

1,3,5-triphenylcyclohexane is a member of the class of benzenes that is cyclohexane in which a hydrogen at positions 1, 3 and 5 is replaced by a phenyl group. It is present as an impurity in polystyrene food containers.

CAS Number28336-57-4
PubChem CID119930
IUPAC Name(3,5-diphenylcyclohexyl)benzene
Molecular FormulaC24H24
Molecular Weight312.4
XLogP6.9
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count3
Heavy Atom Count24
Formal Charge0
Complexity285
SMILES
C1C(CC(CC1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H24/c1-4-10-19(11-5-1)22-16-23(20-12-6-2-7-13-20)18-24(17-22)21-14-8-3-9-15-21/h1-15,22-24H,16-18H2
InChIKey
YVPJVAWPIRGOJN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,3,5-Triphenylcyclohexane
CAS: 28336-57-4
CID: 119930
Formula: C24H24
MW: 312.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight312.4
XLogP36.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count3
Exact Mass312.187800766
Monoisotopic Mass312.187800766
Topological Polar Surface Area0 Ų
Heavy Atom Count24
Formal Charge0
Complexity285
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes