Methyl 5-Bromo-2-methoxynicotinate - CAS 122433-41-4
Catalog: |
BB005399 |
Product Name: |
Methyl 5-Bromo-2-methoxynicotinate |
CAS: |
122433-41-4 |
Synonyms: |
5-bromo-2-methoxy-3-pyridinecarboxylic acid methyl ester; methyl 5-bromo-2-methoxypyridine-3-carboxylate |
IUPAC Name: | methyl 5-bromo-2-methoxypyridine-3-carboxylate |
Description: | Methyl 5-Bromo-2-methoxynicotinate (CAS# 122433-41-4) is a useful research chemical. |
Molecular Weight: | 246.06 |
Molecular Formula: | C8H8BrNO3 |
Canonical SMILES: | COC1=NC=C(C=C1C(=O)OC)Br |
InChI: | InChI=1S/C8H8BrNO3/c1-12-7-6(8(11)13-2)3-5(9)4-10-7/h3-4H,1-2H3 |
InChI Key: | OLQOVEOEHQDKSC-UHFFFAOYSA-N |
Boiling Point: | 271.9 °C at 760 mmHg |
Density: | 1.53 g/cm3 |
Appearance: | Cream crystalline powder |
Storage: | Sealed in dry, Room Temperature |
MDL: | MFCD08064227 |
LogP: | 1.63930 |
GHS Hazard Statement: | H315 (11.36%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2020392154-A1 | Pyridine carbamates and their use as glun2b receptor modulators | 20190614 |
WO-2020249799-A1 | Pyridine carbamates and their use as glun2b receptor modulators | 20190614 |
WO-2020192562-A1 | Substituted heterocyclic amide compound and preparation method therefor and pharmaceutical use thereof | 20190322 |
CN-113508109-A | Substituted heterocyclic amide compound, preparation method and medical application thereof | 20190322 |
WO-2020108579-A1 | Amino-substituted pyridone derivative, preparation method therefor, and pharmaceutical use thereof | 20181128 |
Complexity: | 188 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 244.96876 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 244.96876 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 48.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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