1-Phenyl-1H-imidazole - CAS 7164-98-9
Catalog: |
BB034444 |
Product Name: |
1-Phenyl-1H-imidazole |
CAS: |
7164-98-9 |
Synonyms: |
1-phenylimidazole; 1-phenylimidazole |
IUPAC Name: | 1-phenylimidazole |
Description: | 1-Phenyl-1H-imidazole (CAS# 7164-98-9) is a useful research chemical. |
Molecular Weight: | 144.17 |
Molecular Formula: | C9H8N2 |
Canonical SMILES: | C1=CC=C(C=C1)N2C=CN=C2 |
InChI: | InChI=1S/C9H8N2/c1-2-4-9(5-3-1)11-7-6-10-8-11/h1-8H |
InChI Key: | SEULWJSKCVACTH-UHFFFAOYSA-N |
Boiling Point: | 142 °C (15 mmHg) |
Density: | 1.14 g/cm3 |
Solubility: | 19.7 [ug/mL] (The mean of the results at pH 7.4) |
MDL: | MFCD00041204 |
LogP: | 1.87230 |
GHS Hazard Statement: | H302 (86.67%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112409264-A | Heterogeneous catalysis N-arylation method | 20201130 |
CN-111606855-A | N-heterocyclic carbene carboxylate bidentate ligand, bidentate ruthenium complex, preparation methods and application of N-heterocyclic carbene carboxylate bidentate ligand and bidentate ruthenium complex in catalysis of carboxylic acid-alkyne addition | 20200702 |
EP-3889204-A1 | Method for producing a polyoxyalkylene carbonate polyol | 20200402 |
EP-3885390-A1 | Method for producing an ether estol | 20200325 |
WO-2021191069-A1 | Method for producing an ether esterol | 20200325 |
PMID | Publication Date | Title | Journal |
22590122 | 20120501 | Tetra-kis(1-phenyl-1H-imidazole-κN(3))bis-(thio-cyanato-κN)nickel(II) | Acta crystallographica. Section E, Structure reports online |
22390175 | 20120319 | Syntheses and excitation transfer studies of near-orthogonal free-base porphyrin-ruthenium phthalocyanine dyads and pentad | Inorganic chemistry |
21842885 | 20111121 | Polyamines are traps for reactive intermediates in furan metabolism | Chemical research in toxicology |
21677940 | 20110807 | Pd-carbene catalyzed carbonylation reactions of aryl iodides | Dalton transactions (Cambridge, England : 2003) |
21753975 | 20110401 | (η-All-yl)bromido(1-phenyl-1H-imidazole-κN)palladium(II) | Acta crystallographica. Section E, Structure reports online |
Complexity: | 119 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 144.068748264 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 144.068748264 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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