4-Iodoisoxazole - CAS 847490-69-1
Catalog: |
BB037285 |
Product Name: |
4-Iodoisoxazole |
CAS: |
847490-69-1 |
Synonyms: |
4-iodoisoxazole; 4-iodo-1,2-oxazole |
IUPAC Name: | 4-iodo-1,2-oxazole |
Description: | 4-Iodoisoxazole (CAS# 847490-69-1) is a useful research chemical. |
Molecular Weight: | 194.96 |
Molecular Formula: | C3H2INO |
Canonical SMILES: | C1=C(C=NO1)I |
InChI: | InChI=1S/C3H2INO/c4-3-1-5-6-2-3/h1-2H |
InChI Key: | BKACOOKVHZFHEW-UHFFFAOYSA-N |
Boiling Point: | 214.826 °C at 760 mmHg |
Density: | 2.227 g/cm3 |
MDL: | MFCD09999222 |
LogP: | 1.27920 |
Publication Number | Title | Priority Date |
WO-2021194326-A1 | Aminopyrimidine derivatives and their use as aryl hydrocarbon receptor modulators | 20200327 |
RU-2711558-C1 | Method of producing halogen derivatives of aromatic and heteroaromatic compounds | 20190325 |
EP-3079701-A1 | Soluble guanylate cyclase activators | 20131211 |
US-2016304536-A1 | Soluble guanylate cyclase activators | 20131211 |
US-9611278-B2 | Soluble guanylate cyclase activators | 20131211 |
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 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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