2,4,5-Tribromo-1-methylimidazole - CAS 1003-91-4
Catalog: |
BB000213 |
Product Name: |
2,4,5-Tribromo-1-methylimidazole |
CAS: |
1003-91-4 |
Synonyms: |
2,4,5-tribromo-1-methylimidazole; 2,4,5-tribromo-1-methylimidazole |
IUPAC Name: | 2,4,5-tribromo-1-methylimidazole |
Description: | 2,4,5-Tribromo-1-methylimidazole (CAS# 1003-91-4) is a useful research chemical. |
Molecular Weight: | 318.79 |
Molecular Formula: | C4H3Br3N2 |
Canonical SMILES: | CN1C(=C(N=C1Br)Br)Br |
InChI: | InChI=1S/C4H3Br3N2/c1-9-3(6)2(5)8-4(9)7/h1H3 |
InChI Key: | KAMDVXMJRMNDCQ-UHFFFAOYSA-N |
Boiling Point: | 364.9 °C at 760 mmHg |
Density: | 2.64 g/cm3 |
Storage: | Keep in dark place, Inert atmosphere, 2-8 °C |
MDL: | MFCD00955564 |
LogP: | 2.70760 |
Publication Number | Title | Priority Date |
WO-2021070132-A1 | Bi-aryl dihydroorotate dehydrogenase inhibitors | 20191010 |
CA-3005353-A1 | Purinones as ubiquitin-specific protease 1 inhibitors | 20151120 |
EP-3377493-A1 | Purinones as ubiquitin-specific protease 1 inhibitors | 20151120 |
EP-3377493-B1 | Purinones as ubiquitin-specific protease 1 inhibitors | 20151120 |
JP-2019504821-A | Prinones as ubiquitin-specific protease 1 inhibitors | 20151120 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 317.78259 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 315.78464 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 17.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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