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4-Chlorodiphenylmethane

CAT: 0024-sc-284209Size: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-284209Size:5 g
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CAS Number
831-81-2

Chemical Information

(4-Chlorophenyl)phenylmethane
CAS Number831-81-2
PubChem CID13253
IUPAC Name1-benzyl-4-chlorobenzene
Molecular FormulaC13H11Cl
Molecular Weight202.68
XLogP4.9
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity153
SMILES
C1=CC=C(C=C1)CC2=CC=C(C=C2)Cl
InChI
InChI=1S/C13H11Cl/c14-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10H2
InChIKey
NPOGRKGIBGKRNI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (4-Chlorophenyl)phenylmethane
CAS: 831-81-2
CID: 13253
Formula: C13H11Cl
MW: 202.68
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight202.68
XLogP34.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass202.0549280
Monoisotopic Mass202.0549280
Topological Polar Surface Area0 Ų
Heavy Atom Count14
Formal Charge0
Complexity153
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

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