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9-Bromo-10-phenylanthracene

CAT: 0127-OR60163Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-OR60163Size:1 g
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CAS Number
23674-20-6
MDL Number
MFCD00230983
Purity
=95%
Smiles
Brc1c2ccccc2c(c3ccccc3)c4ccccc14

Chemical Information

9-Bromo-10-phenyl-anthracene
CAS Number23674-20-6
PubChem CID4155836
IUPAC Name9-bromo-10-phenylanthracene
Molecular FormulaC20H13Br
Molecular Weight333.2
XLogP6.7
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Heavy Atom Count21
Formal Charge0
Complexity322
SMILES
C1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=CC=CC=C42)Br
InChI
InChI=1S/C20H13Br/c21-20-17-12-6-4-10-15(17)19(14-8-2-1-3-9-14)16-11-5-7-13-18(16)20/h1-13H
InChIKey
WHGGVVHVBFMGSG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 9-Bromo-10-phenyl-anthracene
CAS: 23674-20-6
CID: 4155836
Formula: C20H13Br
MW: 333.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight333.2
XLogP36.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass332.02006
Monoisotopic Mass332.02006
Topological Polar Surface Area0 Ų
Heavy Atom Count21
Formal Charge0
Complexity322
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