2-(4-Chlorophenyl)imidazole - CAS 4205-05-4
Catalog: |
BB025021 |
Product Name: |
2-(4-Chlorophenyl)imidazole |
CAS: |
4205-05-4 |
Synonyms: |
2-(4-chlorophenyl)-1H-imidazole; 2-(4-chlorophenyl)-1H-imidazole |
IUPAC Name: | 2-(4-chlorophenyl)-1H-imidazole |
Description: | 2-(4-Chlorophenyl)imidazole (CAS# 4205-05-4 ) is a useful research chemical. |
Molecular Weight: | 178.62 |
Molecular Formula: | C9H7ClN2 |
Canonical SMILES: | C1=CC(=CC=C1C2=NC=CN2)Cl |
InChI: | InChI=1S/C9H7ClN2/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h1-6H,(H,11,12) |
InChI Key: | HJCFDCKEUGZLPS-UHFFFAOYSA-N |
Boiling Point: | 365.5 °C at 760 mmHg |
Density: | 1.292 g/cm3 |
MDL: | MFCD04114651 |
LogP: | 2.73010 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
EP-2964028-A1 | Compounds for treatment of cancer | 20130305 |
US-10022356-B2 | Compounds for treatment of cancer | 20130305 |
US-2016015688-A1 | Compounds for treatment of cancer | 20130305 |
US-2018325872-A1 | Compounds for treatment of cancer | 20130305 |
WO-2014138279-A1 | Compounds for treatment of cancer | 20130305 |
PMID | Publication Date | Title | Journal |
18851889 | 20090601 | Synthesis, antimicrobial and antiviral evaluation of substituted imidazole derivatives | European journal of medicinal chemistry |
Complexity: | 144 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 178.0297759 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.0297759 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 28.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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