FFP
2,6-DIFLUOROPHENOL
Created: | 2006-10-10 |
Last modified: | 2011-06-04 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 13 |
Chiral Atom Count | 0 |
Bond Count | 13 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | 2,6-DIFLUOROPHENOL |
Systematic Name (OpenEye OEToolkits) | 2,6-difluorophenol |
Formula | C6 H4 F2 O |
Molecular Weight | 130.092 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Fc1cccc(F)c1O |
SMILES | CACTVS | 3.341 | Oc1c(F)cccc1F |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(c(c1)F)O)F |
Canonical SMILES | CACTVS | 3.341 | Oc1c(F)cccc1F |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(c(c1)F)O)F |
InChI | InChI | 1.03 | InChI=1S/C6H4F2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H |
InChIKey | InChI | 1.03 | CKKOVFGIBXCEIJ-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 94392 |
ChEMBL | CHEMBL1232721 |
CCDC/CSD | VESXOI, ASAZIG |