| CAS Number | 1181458-32-1 |
| Catalog Number | AG019VGV(AGN-PC-0WO7YS) |
| Chemical Name | 2,4-dichloro-1-phenyl-1H-imidazole-5-carbaldehyde |
| IUPAC Name | 2,5-dichloro-3-phenylimidazole-4-carbaldehyde |
| InChI | InChI=1S/C10H6Cl2N2O/c11-9-8(6-15)14(10(12)13-9)7-4-2-1-3-5-7/h1-6H |
| InChI Key | PQDZCIGLVYKTPP-UHFFFAOYSA-N |
| MDL Number | MFCD12197167 |
| Molecular Formula | C10H6Cl2N2O |
| Molecular Weight | 241.0734 |
| SMILES | ClC1=C(C=O)N(C2=CC=CC=C2)C(Cl)=N1 |
| Synonyms | 2,4-dichloro-1-phenyl-1H-imidazole-5-carbaldehyde,
1181458-32-1,
AC1Q3KRV,
CTK7H8120,
ZINC36379458,
AKOS023413116,
MCULE-6418606646,
NE42724,
EN300-45203,
|
| Complexity | 234 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.986g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.071g/mol |
| Monoisotopic Mass | 239.986g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 34.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
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Certificate of Analysis
Lot Number