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2-Methyldiphenylmethane

CAT: 0024-sc-283222ASize: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-283222ASize:1 g
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CAS Number
713-36-0

Chemical Information

2-Benzyltoluene

heat transfer agent; RN given refers to cpd without specified locants

CAS Number713-36-0
PubChem CID69738
IUPAC Name1-benzyl-2-methylbenzene
Molecular FormulaC14H14
Molecular Weight182.26
XLogP4.7
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity155
SMILES
CC1=CC=CC=C1CC2=CC=CC=C2
InChI
InChI=1S/C14H14/c1-12-7-5-6-10-14(12)11-13-8-3-2-4-9-13/h2-10H,11H2,1H3
InChIKey
PQTAUFTUHHRKSS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Benzyltoluene
CAS: 713-36-0
CID: 69738
Formula: C14H14
MW: 182.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight182.26
XLogP34.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass182.109550447
Monoisotopic Mass182.109550447
Topological Polar Surface Area0 Ų
Heavy Atom Count14
Formal Charge0
Complexity155
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