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Dibenzofuran, 1- (3-chlorophenyl) -

CAT: 1266-JH916811Size: 1 EachDry Ice: NoHazardous: No
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CAS Number
2640392-03-4
Molecular Formula
C18H11ClO
Molecular Weight
278.73

Chemical Information

1-(3-Chlorophenyl)dibenzofuran
CAS Number2640392-03-4
PubChem CID156343367
IUPAC Name1-(3-chlorophenyl)dibenzofuran
Molecular FormulaC18H11ClO
Molecular Weight278.7
XLogP5.9
Topological Polar Surface Area13.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity344
SMILES
C1=CC=C2C(=C1)C3=C(C=CC=C3O2)C4=CC(=CC=C4)Cl
InChI
InChI=1S/C18H11ClO/c19-13-6-3-5-12(11-13)14-8-4-10-17-18(14)15-7-1-2-9-16(15)20-17/h1-11H
InChIKey
HZPSWPXFIACCAA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(3-Chlorophenyl)dibenzofuran
CAS: 2640392-03-4
CID: 156343367
Formula: C18H11ClO
MW: 278.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight278.7
XLogP35.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass278.0498427
Monoisotopic Mass278.0498427
Topological Polar Surface Area13.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity344
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