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9,10-ditert-butylanthracene

CAT: 1266-JH738620Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1266-JH738620Size:1 Each
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CAS Number
65482-04-4
UN Code
UN 2811
Hazard Statement
T
Stability
Stable, but air and light sensitive. Incompatible with acids, bases, strong oxidizing agents. Slightly hygroscopic.
Molecular Formula
C22H26
Molecular Weight
290.44184
Product Name Synonym
Anthracene,9,10-bis (1,1-dimethylethyl)
Physical Properties
White or almost white crystalline powder
Hazardous Class
8
Safety Statements
36/37-45
Density
1.035g/cm3
Flash Point
125.1oC
RIDADR
UN 2811
Melting Point
68 - 70 °C (ethanol)

Chemical Information

9,10-Di-tert-butylanthracene
CAS Number65482-04-4
PubChem CID57721973
IUPAC Name9,10-ditert-butylanthracene
Molecular FormulaC22H26
Molecular Weight290.4
XLogP8.3
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity318
SMILES
CC(C)(C)C1=C2C=CC=CC2=C(C3=CC=CC=C31)C(C)(C)C
InChI
InChI=1S/C22H26/c1-21(2,3)19-15-11-7-9-13-17(15)20(22(4,5)6)18-14-10-8-12-16(18)19/h7-14H,1-6H3
InChIKey
FXIDPYQSDRYPMO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 9,10-Di-tert-butylanthracene
CAS: 65482-04-4
CID: 57721973
Formula: C22H26
MW: 290.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight290.4
XLogP38.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass290.203450829
Monoisotopic Mass290.203450829
Topological Polar Surface Area0 Ų
Heavy Atom Count22
Formal Charge0
Complexity318
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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B27540-019-Butylanthracene
OR1073169-019,10-Dibromo-2,6-di-tert-butylanthracene
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