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3-(3-Methylisoxazol-5-yl)propan-1-ol

Catalog Number ACM105658499
CAS 105658-49-9
Structure {[CurrentData.Name]}
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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