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Coronene

CAT: 0926-FC62148-01Size: 0.5 gDry Ice: NoHazardous: No
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CAT#:0926-FC62148-01Size:0.5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
191-07-1
Synonyms
Hexabenzobenzene
MDL Number
MFCD00004134
Smiles
C1=CC2=C3C4=C1C=CC5=C4C6=C (C=C5) C=CC7=C6C3=C (C=C2) C=C7
Molecular Formula
C24H12
Molecular Weight
300.35 g/mol
Controlled
No

Chemical Information

Coronene

Coronene is a ortho- and peri-fused polycyclic arene that consists of six peri-fused benzene rings.

CAS Number191-07-1
PubChem CID9115
IUPAC Namecoronene
Molecular FormulaC24H12
Molecular Weight300.4
XLogP7.2
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count24
Formal Charge0
Complexity376
SMILES
C1=CC2=C3C4=C1C=CC5=C4C6=C(C=C5)C=CC7=C6C3=C(C=C2)C=C7
InChI
InChI=1S/C24H12/c1-2-14-5-6-16-9-11-18-12-10-17-8-7-15-4-3-13(1)19-20(14)22(16)24(18)23(17)21(15)19/h1-12H
InChIKey
VPUGDVKSAQVFFS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Coronene
CAS: 191-07-1
CID: 9115
Formula: C24H12
MW: 300.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight300.4
XLogP37.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass300.093900383
Monoisotopic Mass300.093900383
Topological Polar Surface Area0 Ų
Heavy Atom Count24
Formal Charge0
Complexity376
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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REPAH3601PAH Std Coronene 100ug/mL in Toluene - 1ML
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