| CAS Number | 925905-07-3 |
| Catalog Number | AG01A84E(AGN-PC-016242) |
| Chemical Name | 4-(2,3-Dihydro-1H-indol-1-ylmethyl)aniline |
| IUPAC Name | 4-(2,3-dihydroindol-1-ylmethyl)aniline |
| InChI | InChI=1S/C15H16N2/c16-14-7-5-12(6-8-14)11-17-10-9-13-3-1-2-4-15(13)17/h1-8H,9-11,16H2 |
| InChI Key | YRCYUXVUZBJHOT-UHFFFAOYSA-N |
| MDL Number | MFCD09731491 |
| Molecular Formula | C15H16N2 |
| Molecular Weight | 224.3009 |
| SMILES | NC1=CC=C(CN2C3=C(C=CC=C3)CC2)C=C1 |
| Synonyms | 4-(2,3-dihydro-1H-indol-1-ylmethyl)aniline,
925905-07-3,
AC1Q520U,
CTK7D7434,
ZINC20191870,
AKOS000140203,
MCULE-6316463359,
NE28971,
EN300-60699,
4-[(2,3-dihydro-1H-indol-1-yl)methyl]aniline,
Z1262250822,
|
| Complexity | 245 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.307g/mol |
| Monoisotopic Mass | 224.131g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number