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3,6-Dimethylphenanthrene

CAT: 0024-sc-485005Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-485005Size:100 mg
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CAS Number
1576-67-6

Chemical Information

3,6-Dimethylphenanthrene
CAS Number1576-67-6
PubChem CID15304
IUPAC Name3,6-dimethylphenanthrene
Molecular FormulaC16H14
Molecular Weight206.28
XLogP5.5
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count16
Formal Charge0
Complexity218
SMILES
CC1=CC2=C(C=C1)C=CC3=C2C=C(C=C3)C
InChI
InChI=1S/C16H14/c1-11-3-5-13-7-8-14-6-4-12(2)10-16(14)15(13)9-11/h3-10H,1-2H3
InChIKey
OMIBPZBOAJFEJS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,6-Dimethylphenanthrene
CAS: 1576-67-6
CID: 15304
Formula: C16H14
MW: 206.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight206.28
XLogP35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass206.109550447
Monoisotopic Mass206.109550447
Topological Polar Surface Area0 Ų
Heavy Atom Count16
Formal Charge0
Complexity218
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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OR10774233,6-Dimethylphenanthrene
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