5-Bromo-2(1H)-pyridone - CAS 13466-38-1
Catalog: |
BB007981 |
Product Name: |
5-Bromo-2(1H)-pyridone |
CAS: |
13466-38-1 |
Synonyms: |
5-bromo-1H-pyridin-2-one |
IUPAC Name: | 5-bromo-1H-pyridin-2-one |
Description: | 5-Bromo-2(1H)-pyridone (CAS# 13466-38-1) is a useful research chemical. |
Molecular Weight: | 174.00 |
Molecular Formula: | C5H4BrNO |
Canonical SMILES: | C1=CC(=O)NC=C1Br |
InChI: | InChI=1S/C5H4BrNO/c6-4-1-2-5(8)7-3-4/h1-3H,(H,7,8) |
InChI Key: | NDMZZQRNZFWMEZ-UHFFFAOYSA-N |
Boiling Point: | 305.9 ℃ at 760 mmHg |
Purity: | 98 % |
Density: | 1.776 g/cm3 |
Appearance: | Off-white to yellow-brown crystalline powder |
Storage: | Keep in dark place, Inert atmosphere, Room temperature |
MDL: | MFCD00234042 |
LogP: | 1.54970 |
GHS Hazard Statement: | H302 (85.11%): 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 |
CN-113354631-A | 1,3, 4-oxadiazole derivative and preparation method and application thereof | 20210601 |
CN-112679420-A | Preparation method of 2,5-dibromopyridine | 20201227 |
WO-2021202796-A1 | Pyrrolidine-pyrazoles as pyruvate kinase activators | 20200401 |
WO-2021180966-A1 | Bcl-2 family proteins modulating compounds for cancer treatment | 20200313 |
WO-2021156439-A1 | Triazole compounds as adenosine receptor antagonists | 20200206 |
Complexity: | 171 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.94763 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.94763 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 29.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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Related Functional Groups
Pyridines
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