JZ2
5-chloro-2-methylphenol
Created: | 2009-06-16 |
Last modified: | 2011-06-04 |
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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 | 5-chloro-2-methylphenol |
Systematic Name (OpenEye OEToolkits) | 5-chloro-2-methyl-phenol |
Formula | C7 H7 Cl O |
Molecular Weight | 142.583 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Clc1cc(O)c(cc1)C |
SMILES | CACTVS | 3.370 | Cc1ccc(Cl)cc1O |
SMILES | OpenEye OEToolkits | 1.7.0 | Cc1ccc(cc1O)Cl |
Canonical SMILES | CACTVS | 3.370 | Cc1ccc(Cl)cc1O |
Canonical SMILES | OpenEye OEToolkits | 1.7.0 | Cc1ccc(cc1O)Cl |
InChI | InChI | 1.03 | InChI=1S/C7H7ClO/c1-5-2-3-6(8)4-7(5)9/h2-4,9H,1H3 |
InChIKey | InChI | 1.03 | KKFPXGXMSBBNJI-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 79192 |