3-Amino-4-methyl-1,2,5-oxadiazole - CAS 17647-70-0
Catalog: |
BB013226 |
Product Name: |
3-Amino-4-methyl-1,2,5-oxadiazole |
CAS: |
17647-70-0 |
Synonyms: |
4-methyl-1,2,5-oxadiazol-3-amine; 4-methyl-1,2,5-oxadiazol-3-amine |
IUPAC Name: | 4-methyl-1,2,5-oxadiazol-3-amine |
Description: | 3-Amino-4-methyl-1,2,5-oxadiazole (CAS# 17647-70-0) is a useful research chemical. |
Molecular Weight: | 99.09 |
Molecular Formula: | C3H5N3O |
Canonical SMILES: | CC1=NON=C1N |
InChI: | InChI=1S/C3H5N3O/c1-2-3(4)6-7-5-2/h1H3,(H2,4,6) |
InChI Key: | QIEJLLIYONRHBH-UHFFFAOYSA-N |
Boiling Point: | 208 °C at 760 mmHg |
Density: | 1.283 g/cm3 |
LogP: | 0.54140 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021152037-A | Heterocyclic amide compound | 20210611 |
JP-2020164533-A | Heterocyclic amide compound | 20200529 |
WO-2020030781-A1 | Tricyclic inhibitors of hepatitis b virus | 20180810 |
RU-2671414-C1 | Method of obtaining aminofurazans | 20180629 |
WO-2019122347-A1 | N-(1,2,5-oxadiazol-3-yl)-benzamide compounds and their use as herbicides | 20171222 |
Complexity: | 67.2 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 99.043261792 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 99.043261792 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 64.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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Related Functional Groups
Amines and Anilines
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