| CAS Number | 1324087-02-6 |
| Catalog Number | AG01BD9Q |
| Chemical Name | 3-(1H-pyrrol-1-yl)aniline hydrochloride |
| IUPAC Name | 3-pyrrol-1-ylaniline;hydrochloride |
| InChI | InChI=1S/C10H10N2.ClH/c11-9-4-3-5-10(8-9)12-6-1-2-7-12;/h1-8H,11H2;1H |
| InChI Key | IDNKYQVJWBHBGJ-UHFFFAOYSA-N |
| MDL Number | MFCD19711780 |
| Molecular Formula | C10H11ClN2 |
| Molecular Weight | 194.6607 |
| SMILES | Cl.NC1=CC(N2C=CC=C2)=CC=C1 |
| Synonyms | 3-(1H-pyrrol-1-yl)aniline hydrochloride,
C10H11ClN2,
1324087-02-6,
AKOS030504513,
MCULE-5294240862,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.662g/mol |
| Monoisotopic Mass | 194.061g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 31A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number