6-Bromoquinolin-2(1H)-one - CAS 1810-66-8
Catalog: |
BB013784 |
Product Name: |
6-Bromoquinolin-2(1H)-one |
CAS: |
1810-66-8 |
Synonyms: |
6-bromo-1H-quinolin-2-one |
IUPAC Name: | 6-bromo-1H-quinolin-2-one |
Description: | 6-Bromoquinolin-2(1H)-one (CAS# 1810-66-8) is a useful intermediate for the synthesis of other quinoline derivatives. |
Molecular Weight: | 224.05 |
Molecular Formula: | C9H6BrNO |
Canonical SMILES: | C1=CC2=C(C=CC(=O)N2)C=C1Br |
InChI: | InChI=1S/C9H6BrNO/c10-7-2-3-8-6(5-7)1-4-9(12)11-8/h1-5H,(H,11,12) |
InChI Key: | YLAFBGATSQRSTB-UHFFFAOYSA-N |
Boiling Point: | 393.8 ℃ at 760 mmHg |
Purity: | > 95 % |
Density: | 1.62 g/cm3 |
MDL: | MFCD08703169 |
LogP: | 2.70290 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021127166-A1 | Inhibitors of enl/af9 yeats | 20191217 |
WO-2020259668-A1 | Tricyclic compound, preparation method therefor and use thereof | 20190628 |
US-2020354345-A1 | Modulators of thr-beta and methods of use thereof | 20190508 |
WO-2020227549-A1 | MODULATORS OF THR-β AND METHODS OF USE THEREOF | 20190508 |
US-11091467-B2 | Modulators of THR-β and methods of use thereof | 20190508 |
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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