4-bromo-2,6-dimethylpyridine - CAS 5093-70-9
Catalog: |
BB027276 |
Product Name: |
4-bromo-2,6-dimethylpyridine |
CAS: |
5093-70-9 |
Synonyms: |
4-bromo-2,6-dimethylpyridine |
IUPAC Name: | 4-bromo-2,6-dimethylpyridine |
Description: | 4-bromo-2,6-dimethylpyridine (CAS# 5093-70-9) is a reagent used in the synthesis of novel isoquinoline derivatives of potential interest for pharmaceutical, biomedical, and energy-related research. |
Molecular Weight: | 186.05 |
Molecular Formula: | C7H8BrN |
Canonical SMILES: | CC1=CC(=CC(=N1)C)Br |
InChI: | InChI=1S/C7H8BrN/c1-5-3-7(8)4-6(2)9-5/h3-4H,1-2H3 |
InChI Key: | VTRFAYHJKSKHGY-UHFFFAOYSA-N |
Boiling Point: | 207.3 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.415 g/cm43 |
MDL: | MFCD00671475 |
LogP: | 2.46090 |
GHS Hazard Statement: | H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021172359-A1 | Cdk9 inhibitor prodrug and liposome including the same | 20200225 |
WO-2021123291-A1 | Oga inhibitor compounds | 20191218 |
CN-112807930-A | Application of metal organic framework compound MFM-520 in adsorption, separation and conversion of acidic gas pollutants in air | 20191115 |
WO-2021094312-A1 | Pyrrolidine and bicycloheteroaryl containing oga inhibitor compounds | 20191111 |
WO-2021067657-A1 | Substituted carbazole compounds | 20191004 |
Complexity: | 84.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.98401 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.98401 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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