| CAS Number | 187668-94-6 |
| Catalog Number | AG01A3JR(AGN-PC-03J76Z) |
| Chemical Name | 1-benzyl-1H-indol-6-amine |
| IUPAC Name | 1-benzylindol-6-amine |
| InChI | InChI=1S/C15H14N2/c16-14-7-6-13-8-9-17(15(13)10-14)11-12-4-2-1-3-5-12/h1-10H,11,16H2 |
| InChI Key | UOQORHZEJBHZAP-UHFFFAOYSA-N |
| MDL Number | MFCD11638172 |
| Molecular Formula | C15H14N2 |
| Molecular Weight | 222.2851 |
| SMILES | NC1=CC2=C(C=CN2CC2=CC=CC=C2)C=C1 |
| Synonyms | 1-benzyl-1H-indol-6-amine,
1-Benzyl-1H-indol-6-ylamine,
187668-94-6,
SCHEMBL396279,
UOQORHZEJBHZAP-UHFFFAOYSA-N,
ZINC37222325,
NE58224,
N/A,
|
| Complexity | 247 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.291g/mol |
| Monoisotopic Mass | 222.116g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 31A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number