| CAS Number | 10524-65-9 |
| Catalog Number | AG01BKA1(AGN-PC-0CY62U) |
| Chemical Name | 1,3-Dimethyl-1H-pyrrole |
| IUPAC Name | 1,3-dimethylpyrrole |
| InChI | InChI=1S/C6H9N/c1-6-3-4-7(2)5-6/h3-5H,1-2H3 |
| InChI Key | CTWQGTOWGFCWNW-UHFFFAOYSA-N |
| MDL Number | MFCD12923465 |
| Molecular Formula | C6H9N |
| Molecular Weight | 95.1424 |
| SMILES | CC1=CN(C)C=C1 |
| Synonyms | 1,3-Dimethyl-1H-pyrrole,
1H-Pyrrole, 1,3-dimethyl-,
10524-65-9,
CTWQGTOWGFCWNW-UHFFFAOYSA-N,
1,3-dimethylpyrrole,
CID10964417,
|
| Complexity | 61.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 95.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 95.145g/mol |
| Monoisotopic Mass | 95.073g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 4.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number