2-Bromopyrimidine - CAS 4595-60-2
Catalog: |
BB026033 |
Product Name: |
2-Bromopyrimidine |
CAS: |
4595-60-2 |
Synonyms: |
2-bromopyrimidine |
IUPAC Name: | 2-bromopyrimidine |
Description: | 2-Bromopyrimidine (CAS# 4595-60-2) is a useful research chemical. |
Molecular Weight: | 158.98 |
Molecular Formula: | C4H3BrN2 |
Canonical SMILES: | C1=CN=C(N=C1)Br |
InChI: | InChI=1S/C4H3BrN2/c5-4-6-2-1-3-7-4/h1-3H |
InChI Key: | PGFIHORVILKHIA-UHFFFAOYSA-N |
Boiling Point: | 62-64 °C (1.5 mmHg) |
Melting Point: | 54.5-57.5°C |
Flash Point: | 105°C |
Purity: | 98 % |
Density: | 1.726 g/cm3 |
Appearance: | Pale yellow crystals |
Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00014601 |
LogP: | 1.23910 |
Refractive Index: | 1.568 |
Stability: | Stable at room temperature in closed containers under normal storage and handling conditions. |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
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CN-214210402-U | Production mixing arrangement for 2-bromopyrimidine | 20201221 |
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PMID | Publication Date | Title | Journal |
21754730 | 20110601 | 4,6-Dichloro-5-(2-meth-oxy-phen-oxy)-2,2'-bipyrimidine | Acta crystallographica. Section E, Structure reports online |
21588792 | 20101002 | trans-Bromido(pyrimidinyl-κC)bis-(triphenyl-phosphane-κP)palladium(II) | Acta crystallographica. Section E, Structure reports online |
20559487 | 20100428 | Halogenated indole alkaloids from marine invertebrates | Marine drugs |
18792960 | 20090701 | Unexpected rearrangement of enantiomerically pure 3-aminoquinuclidine as a simple way of preparing diastereomeric octahydropyrrolo[2,3-c]pyridine derivatives | Chirality |
14518131 | 20030907 | New pyrimidine- and fluorene-containing oligo(arylene)s: synthesis, crystal structures, optoelectronic properties and a theoretical study | Organic & biomolecular chemistry |
Complexity: | 51.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.94796 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.94796 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 25.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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