(5-Cyclopropyl-3-isoxazolyl)methanol - CAS 1060817-48-2
Catalog: |
BB001817 |
Product Name: |
(5-Cyclopropyl-3-isoxazolyl)methanol |
CAS: |
1060817-48-2 |
Synonyms: |
(5-cyclopropyl-1,2-oxazol-3-yl)methanol |
IUPAC Name: | (5-cyclopropyl-1,2-oxazol-3-yl)methanol |
Description: | (5-Cyclopropyl-3-isoxazolyl)methanol (CAS# 1060817-48-2) is a useful research chemical. |
Molecular Weight: | 139.15 |
Molecular Formula: | C7H9NO2 |
Canonical SMILES: | C1CC1C2=CC(=NO2)CO |
InChI: | InChI=1S/C7H9NO2/c9-4-6-3-7(10-8-6)5-1-2-5/h3,5,9H,1-2,4H2 |
InChI Key: | NUYRQGMZXHHVQB-UHFFFAOYSA-N |
Purity: | 95 % |
MDL: | MFCD11053969 |
LogP: | 1.04430 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P316, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
AU-2017382360-A1 | Compounds, compositions and methods of use | 20161223 |
EP-3557998-A1 | Compouns, compositions and methods of use | 20161223 |
JP-2020503314-A | Compounds, compositions, and methods of use | 20161223 |
WO-2018119395-A1 | Compouns, compositions and methods of use | 20161223 |
US-2020270211-A1 | Compounds, compositions and methods of use | 20161223 |
Complexity: | 125 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 139.06332853 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 139.06332853 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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