| CAS Number | 499793-84-9 |
| Catalog Number | AG00IMJL(AGN-PC-0OB4FQ) |
| Chemical Name | 1H-Pyrrole, 1-(4-propylphenyl)-2,5-di-2-thienyl- |
| IUPAC Name | 1-(4-propylphenyl)-2,5-dithiophen-2-ylpyrrole |
| InChI | InChI=1S/C21H19NS2/c1-2-5-16-8-10-17(11-9-16)22-18(20-6-3-14-23-20)12-13-19(22)21-7-4-15-24-21/h3-4,6-15H,2,5H2,1H3 |
| InChI Key | JFTYJFYWQQLLFG-UHFFFAOYSA-N |
| MDL Number | MFCD30721945 |
| Molecular Formula | C21H19NS2 |
| Molecular Weight | 349.5123 |
| SMILES | C(CC)c1ccc(cc1)n1c(ccc1c1cccs1)c1cccs1 |
| Synonyms | 1-(4-Propylphenyl)-2,5-di(2-thienyl)-1H-pyrrole,
499793-84-9,
P2210,
|
| Complexity | 369 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 349.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 349.51g/mol |
| Monoisotopic Mass | 349.096g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 61.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 6.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number