[Go]
PubMed | Entrez | Structure | PubChem | Help
PubChem » Compound Summary
 


2,6-difluoronaphthalene - Compound Summary (CID 640615)

Depositor-Supplied Synonyms: (Total: 3)
Sort:
2,6-difluoronaphthalene
naphthalene, 2,6-difluoro-
InChI=1/C10H6F2/c11-9-3-1-7-5-10(12)4-2-8(7)6-9/h1-6


Properties Computed from Structure:
Molecular Weight164.151446 [g/mol]
Molecular FormulaC10H6F2
XLogP3-AA3.4
H-Bond Donor0
H-Bond Acceptor2
Rotatable Bond Count0
Exact Mass164.043757
MonoIsotopic Mass164.043757
Topological Polar Surface Area0
Heavy Atom Count12
Formal Charge0
Complexity140
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1


Descriptors Computed from Structure:
IUPAC Name: 2,6-difluoronaphthalene
Canonical SMILES: C1=CC2=C(C=CC(=C2)F)C=C1F
InChI: InChI=1S/C10H6F2/c11-9-3-1-7-5-10(12)4-2-8(7)6-9/h1-6H
InChIKey: IBDPHEOBZWYQSC-UHFFFAOYSA-N


Compound Information:
CID 640615   
Create Date: 2006-01-25


Similar Compounds: 193 Links
Similar Conformers: 15139 Links    View Conformers


Substance Information:
Substances: 3 Links

Category: [for same structure substances]
Biological Properties: 1 Link
   DiscoveryGate ( 1 )
SID 24633435 - External ID: 640615

Physical Properties: 1 Link
   NMRShiftDB ( 1 )
SID 592898 - External ID: 10023337

Substance Vendors: 1 Link
   ChemSpider ( 1 )
SID 43762655 - External ID: 555964
     

2D

3D
Compound ID640615
Molecular Weight164.151446 [g/mol]
Molecular FormulaC10H6F2
XLogP3-AA3.4
H-Bond Donor0
H-Bond Acceptor2


 Write to Helpdesk | Disclaimer | Privacy statement | Accessibility