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3-(3-Methylisoxazol-5-yl)propan-1-ol
| Catalog Number | ACM105658499 |
| CAS | 105658-49-9 |
| Structure |  |
| IUPAC Name | 3-(3-methyl-1,2-oxazol-5-yl)propan-1-ol |
| Synonyms | 3-(3-methylisoxazol-5-yl)propan-1-ol;105658-49-9;3-Methyl-5-isoxazolepropanol;3-(3-methyl-1,2-oxazol-5-yl)propan-1-ol;3-(3-Methyl-5-isoxazolyl)-1-propanol;5-(3-hydroxypropyl)-3-methyl isoxazole;5-Isoxazolepropanol,3-methyl-;ACMC-1C8R5;SCHEMBL1052595;DTXSID00434043;AMY18164;ZINC2540028;AKOS005207024;MCULE-5126782118;3-(3-Methylisoxazol-5-yl)propyl alcohol;AC-13243;AS-50092;AB0033057;DB-059374;CS-0061410;FT-0714639;X6519;L-3181;J-510623;F2147-0167 |
| Molecular Weight | 141.17g/mol |
| Molecular Formula | C7H11NO2 |
| Canonical SMILES | CC1=NOC(=C1)CCCO |
| InChI | InChI=1S/C7H11NO2/c1-6-5-7(10-8-6)3-2-4-9/h5,9H,2-4H2,1H3 |
| InChI Key | WLKCJYLGRDETLU-UHFFFAOYSA-N |
| Boiling Point | 270.5ºC at 760mmHg |
| Flash Point | 117.4ºC |
| Purity | 96% |
| Density | 1.098g/cm³ |
| Complexity | 97.6 |
| Covalently-Bonded Unit Count | 1 |
| Exact Mass | 141.078978594g/mol |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Monoisotopic Mass | 141.078978594g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.3Ų |
| X Log P3 | 0.7 |
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