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1,6-Dimethylnaphthalene

CAT: 0013-GTR19245058-01Size: 50 mgDry Ice: NoHazardous: No
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Description
1,6-Dimethylnaphthalene is an organic compound known for its activity as a fragrance and enhancer. It can be utilized in the synthesis of specific high-performance materials and acts as a catalyst in certain chemical reactions. Additionally, 1,6-Dimethylnaphthalene is studied in the fields of compound development and environmental science.
CAS Number
575-43-9
Field of Research
Metabolism Research
Smiles
CC1=CC2=CC=CC (=C2C=C1) C
Molecular Formula
C12H12
Molecular Weight
156.22
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1,6-Dimethylnaphthalene

1,6-dimethylnaphthalene is a dimethylnaphthalene.

CAS Number575-43-9
PubChem CID11328
IUPAC Name1,6-dimethylnaphthalene
Molecular FormulaC12H12
Molecular Weight156.22
XLogP4.4
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity150
SMILES
CC1=CC2=CC=CC(=C2C=C1)C
InChI
InChI=1S/C12H12/c1-9-6-7-12-10(2)4-3-5-11(12)8-9/h3-8H,1-2H3
InChIKey
CBMXCNPQDUJNHT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,6-Dimethylnaphthalene
CAS: 575-43-9
CID: 11328
Formula: C12H12
MW: 156.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight156.22
XLogP34.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass156.093900383
Monoisotopic Mass156.093900383
Topological Polar Surface Area0 Ų
Heavy Atom Count12
Formal Charge0
Complexity150
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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