| CAS Number | 23593-71-7 |
| Catalog Number | AG00C2V4(AGN-PC-00KRDD) |
| Chemical Name | 1-[(4-Chlorophenyl)diphenylmethyl]-1H-imidazole |
| IUPAC Name | 1-[(4-chlorophenyl)-diphenylmethyl]imidazole |
| InChI | InChI=1S/C22H17ClN2/c23-21-13-11-20(12-14-21)22(25-16-15-24-17-25,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-17H |
| InChI Key | BLNLHAFFGFCSRK-UHFFFAOYSA-N |
| MDL Number | MFCD23103192 |
| Molecular Formula | C22H17ClN2 |
| Molecular Weight | 344.8368 |
| SMILES | ClC1=CC=C(C(N2C=CN=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C=C1 |
| Synonyms | 23593-71-7,
Clotrimazole Impurity B,
1-[(4-Chlorophenyl)diphenylmethyl]-1H-imidazole,
para-Clotrimazole Isomer,
1-(4-Chlorotrityl)-1H-imidazole,
SCHEMBL7156136,
DTXSID50517375,
BLNLHAFFGFCSRK-UHFFFAOYSA-N,
CDD 3532,
ZINC4215446,
1-[(p-Chlorophenyl)diphenylmethyl]imidazole,
1-(p-Chloro-|A,|A-diphenylbenzyl)imidazole,
FT-0665134,
1-[(4-chlorophenyl)-diphenylmethyl]imidazole,
1-[(4-Chlorophenyl)(diphenyl)methyl]-1H-imidazole,
1-[(p-chlorophenyl)-(bisphenyl)-methyl]-imidazole,
Clotrimazole Impurity A,
|
| Complexity | 388 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 344.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 344.842g/mol |
| Monoisotopic Mass | 344.108g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number