| CAS Number | 1431963-41-5 |
| Catalog Number | AG00HWTQ(AGN-PC-0WBB3H) |
| Chemical Name | 4-(Indol-1-yl)aniline hydrochloride |
| IUPAC Name | 4-indol-1-ylaniline;hydrochloride |
| InChI | InChI=1S/C14H12N2.ClH/c15-12-5-7-13(8-6-12)16-10-9-11-3-1-2-4-14(11)16;/h1-10H,15H2;1H |
| InChI Key | LVGDFUPLIFKNGK-UHFFFAOYSA-N |
| MDL Number | MFCD25371062 |
| Molecular Formula | C14H13ClN2 |
| Molecular Weight | 244.7194 |
| SMILES | Cl.NC1=CC=C(N2C3=C(C=CC=C3)C=C2)C=C1 |
| Synonyms | 1431963-41-5,
4-(Indol-1-yl)aniline hydrochloride,
MFCD25371062,
AKOS024395121,
MCULE-5302783422,
4-(1H-Indol-1-yl)aniline hydrochloride,
4-(1H-indol-1-yl)aniline,
|
| Complexity | 233 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.722g/mol |
| Monoisotopic Mass | 244.077g/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
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Certificate of Analysis
Lot Number