MWM
4-fluoro-2-methylphenol
Created: | 2019-04-23 |
Last modified: | 2019-09-11 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 16 |
Chiral Atom Count | 0 |
Bond Count | 16 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | 4-fluoro-2-methylphenol |
Systematic Name (OpenEye OEToolkits) | 4-fluoranyl-2-methyl-phenol |
Formula | C7 H7 F O |
Molecular Weight | 126.128 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Cc1c(O)ccc(c1)F |
SMILES | CACTVS | 3.385 | Cc1cc(F)ccc1O |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(ccc1O)F |
Canonical SMILES | CACTVS | 3.385 | Cc1cc(F)ccc1O |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(ccc1O)F |
InChI | InChI | 1.03 | InChI=1S/C7H7FO/c1-5-4-6(8)2-3-7(5)9/h2-4,9H,1H3 |
InChIKey | InChI | 1.03 | GKQDDKKGDIVDAG-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 136295 |
ChEMBL | CHEMBL224550 |