5-Bromo-2-iodopyridin-3-ol - CAS 188057-49-0
Catalog: |
BB014485 |
Product Name: |
5-Bromo-2-iodopyridin-3-ol |
CAS: |
188057-49-0 |
Synonyms: |
5-bromo-2-iodopyridin-3-ol |
IUPAC Name: | 5-bromo-2-iodopyridin-3-ol |
Description: | 5-Bromo-2-iodopyridin-3-ol (CAS# 188057-49-0) is used in the preparation of bicyclic heterocyclic compounds as acetyl-CoA carboxylase (ACC) inhibitors. |
Molecular Weight: | 299.89 |
Molecular Formula: | C5H3BrINO |
Canonical SMILES: | C1=C(C(=NC=C1Br)I)O |
InChI: | InChI=1S/C5H3BrINO/c6-3-1-4(9)5(7)8-2-3/h1-2,9H |
InChI Key: | TYKCQFLONIEXBQ-UHFFFAOYSA-N |
Boiling Point: | 325.09 °C at 760 mmHg |
Purity: | 95 % |
Density: | 2.513 g/cm3 |
LogP: | 2.15430 |
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, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021178780-A1 | Indazoles and azaindazoles as lrrk2 inhibitors | 20200306 |
WO-2020264420-A1 | Heterocyclic kinase inhibitors and products and uses thereof | 20190628 |
WO-2020005882-A1 | Heteroaryl compounds for treating huntington's disease | 20180627 |
EP-3814360-A1 | Heteroaryl compounds for treating huntington's disease | 20180627 |
TW-201940471-A | Myocardial ganglion inhibitor | 20180119 |
Complexity: | 103 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 298.84427 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 298.84427 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 33.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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