0NX
(5-phenyl-1,2-oxazol-3-yl)methanol
Created: | 2012-03-27 |
Last modified: | 2013-01-25 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 22 |
Chiral Atom Count | 0 |
Bond Count | 23 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | (5-phenyl-1,2-oxazol-3-yl)methanol |
Systematic Name (OpenEye OEToolkits) | (5-phenyl-1,2-oxazol-3-yl)methanol |
Formula | C10 H9 N O2 |
Molecular Weight | 175.184 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | OCc2noc(c1ccccc1)c2 |
SMILES | CACTVS | 3.370 | OCc1cc(on1)c2ccccc2 |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)c2cc(no2)CO |
Canonical SMILES | CACTVS | 3.370 | OCc1cc(on1)c2ccccc2 |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)c2cc(no2)CO |
InChI | InChI | 1.03 | InChI=1S/C10H9NO2/c12-7-9-6-10(13-11-9)8-4-2-1-3-5-8/h1-6,12H,7H2 |
InChIKey | InChI | 1.03 | BPAFLGGUEBMWRN-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 1481082 |