3-Bromo-2-methyl-5-nitropyridine - CAS 186593-42-0
Catalog: |
BB014349 |
Product Name: |
3-Bromo-2-methyl-5-nitropyridine |
CAS: |
186593-42-0 |
Synonyms: |
3-bromo-2-methyl-5-nitropyridine; 3-bromo-2-methyl-5-nitropyridine |
IUPAC Name: | 3-bromo-2-methyl-5-nitropyridine |
Description: | 3-Bromo-2-methyl-5-nitropyridine (CAS# 186593-42-0) is a useful research chemical. |
Molecular Weight: | 217.02 |
Molecular Formula: | C6H5BrN2O2 |
Canonical SMILES: | CC1=C(C=C(C=N1)[N+](=O)[O-])Br |
InChI: | InChI=1S/C6H5BrN2O2/c1-4-6(7)2-5(3-8-4)9(10)11/h2-3H,1H3 |
InChI Key: | QWAOQTGMEGSRLN-UHFFFAOYSA-N |
Boiling Point: | 270.6 °C at 760 mmHg |
Density: | 1.709 g/cm3 |
MDL: | MFCD08688606 |
LogP: | 2.58390 |
Publication Number | Title | Priority Date |
US-2020360353-A1 | Macrocyclic azolopyridine derivatives as eed and prc2 modulators | 20190315 |
WO-2020190754-A1 | Macrocyclic azolopyridine derivatives as eed and prc2 modulators | 20190315 |
TW-202102495-A | Macrocyclic azolopyridine derivatives as eed and prc2 modulators | 20190315 |
US-10973805-B2 | Macrocyclic azolopyridine derivatives as EED and PRC2 modulators | 20190315 |
TW-202039436-A | Inhibitors of tgf-beta r1 (alk5) useful to treat cell proliferation disorders | 20181227 |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.95344 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.95344 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 58.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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