6-Bromo-4-hydroxyquinoline - CAS 145369-94-4
Catalog: |
BB043175 |
Product Name: |
6-Bromo-4-hydroxyquinoline |
CAS: |
145369-94-4 |
Synonyms: |
4-HYDROXY-6-BROMOQUINOLINE; 4,7-DICHLORO-8-METHYLQUINOLINE; 6-BROMOQUINOLIN-4-OL; 6-BROMOQUINOLIN-4-ONE; 6-BROMO-4-QUINOLINOL; 6-BROMO-4-HYDROXYQUINOLINE |
IUPAC Name: | 6-bromo-1H-quinolin-4-one |
Description: | 6-Bromo-4-hydroxyquinoline (CAS# 145369-94-4 ) is a useful research chemical. |
Molecular Weight: | 224.05 |
Molecular Formula: | C9H6BrNO |
Canonical SMILES: | C1=CC2=C(C=C1Br)C(=O)C=CN2 |
InChI: | InChI=1S/C9H6BrNO/c10-6-1-2-8-7(5-6)9(12)3-4-11-8/h1-5H,(H,11,12) |
InChI Key: | XKLBNOHKHRAXKK-UHFFFAOYSA-N |
Boiling Point: | 321.7 °C at 760 mmHg |
Purity: | 96 % |
Density: | 1.62 g/cm3 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, and P501 |
Signal Word: | Warning |
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: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 222.96328 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 29.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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Halides
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