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2-Methylanthracene

CAT: 0127-OR1027537-02Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1027537-02Size:250 mg
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CAS Number
613-12-7
Synonyms
2-methylanthracene
Purity
99%
Smiles
CC1=CC2=CC3=CC=CC=C3C=C2C=C1

Chemical Information

2-Methylanthracene

structure given in first source

CAS Number613-12-7
PubChem CID11936
IUPAC Name2-methylanthracene
Molecular FormulaC15H12
Molecular Weight192.25
XLogP5.1
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count15
Formal Charge0
Complexity220
SMILES
CC1=CC2=CC3=CC=CC=C3C=C2C=C1
InChI
InChI=1S/C15H12/c1-11-6-7-14-9-12-4-2-3-5-13(12)10-15(14)8-11/h2-10H,1H3
InChIKey
GYMFBYTZOGMSQJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Methylanthracene
CAS: 613-12-7
CID: 11936
Formula: C15H12
MW: 192.25
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight192.25
XLogP35.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass192.093900383
Monoisotopic Mass192.093900383
Topological Polar Surface Area0 Ų
Heavy Atom Count15
Formal Charge0
Complexity220
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