7-bromo-1-hydroxyisoquinoline - CAS 223671-15-6
Catalog: |
BB017562 |
Product Name: |
7-bromo-1-hydroxyisoquinoline |
CAS: |
223671-15-6 |
Synonyms: |
7-bromo-2H-isoquinolin-1-one |
IUPAC Name: | 7-bromo-2H-isoquinolin-1-one |
Description: | 7-bromo-1-hydroxyisoquinoline (CAS# 223671-15-6) is a useful research chemical. |
Molecular Weight: | 224.05 |
Molecular Formula: | C9H6BrNO |
Canonical SMILES: | C1=CC(=CC2=C1C=CNC2=O)Br |
InChI: | InChI=1S/C9H6BrNO/c10-7-2-1-6-3-4-11-9(12)8(6)5-7/h1-5H,(H,11,12) |
InChI Key: | DSOKREQUHLPVFR-UHFFFAOYSA-N |
Boiling Point: | 427.5 °C at 760 mmHg |
Melting Point: | 248-250 °C |
Purity: | 95 % |
Density: | 1.62 g/cm3 |
Appearance: | White to yellow of beige powder or crystals |
MDL: | MFCD02093963 |
LogP: | 2.29060 |
GHS Hazard Statement: | H302 (90.7%): 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 |
WO-2021155316-A1 | Compounds and uses thereof | 20200129 |
WO-2021127166-A1 | Inhibitors of enl/af9 yeats | 20191217 |
CN-111825656-A | Inhibitors of protein arginine methyltransferase 5(PRMT5), pharmaceutical products thereof, and methods thereof | 20190415 |
WO-2020160180-A1 | Compounds and uses thereof | 20190129 |
KR-20200119859-A | Inhibitors of protein arginine methyltransferase 5 (PRMT 5), pharmaceutical products thereof, and methods thereof | 20180309 |
Complexity: | 227 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 222.96328 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 222.96328 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 29.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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Quinoline/Isoquinoline
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