2-Iodooxazole - CAS 877614-97-6
Catalog: |
BB038624 |
Product Name: |
2-Iodooxazole |
CAS: |
877614-97-6 |
Synonyms: |
2-iodooxazole; 2-iodo-1,3-oxazole |
IUPAC Name: | 2-iodo-1,3-oxazole |
Description: | 2-Iodooxazole (CAS# 877614-97-6) is a useful research chemical. |
Molecular Weight: | 194.96 |
Molecular Formula: | C3H2INO |
Canonical SMILES: | C1=COC(=N1)I |
InChI: | InChI=1S/C3H2INO/c4-3-5-1-2-6-3/h1-2H |
InChI Key: | QIXCSHIEHGEJGB-UHFFFAOYSA-N |
MDL: | MFCD15527546 |
LogP: | 1.27920 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
JP-2021134167-A | Iodine oxazole compound production method, oxazole compound production method | 20200227 |
US-2021130365-A1 | 2-azaspiro[3.4]octane derivatives as m4 agonists | 20191009 |
WO-2021070091-A1 | 5-oxa-2-azaspiro[3.4]octane derivatives as m4 agonists | 20191009 |
EP-3771714-A1 | Nitrogen-containing heterocycles as pesticides | 20190730 |
CN-111170986-A | Inhibitors of bruton's tyrosine kinase | 20181113 |
Complexity: | 50.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 194.91811 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.91811 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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Related Functional Groups
Oxazole/Thiazole
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