| CAS Number | 926227-25-0 |
| Catalog Number | AG019WBH(AGN-PC-0WO65D) |
| Chemical Name | 1-(3-Ethyl-1-benzofuran-2-yl)ethan-1-amine |
| IUPAC Name | 1-(3-ethyl-1-benzofuran-2-yl)ethanamine |
| InChI | InChI=1S/C12H15NO/c1-3-9-10-6-4-5-7-11(10)14-12(9)8(2)13/h4-8H,3,13H2,1-2H3 |
| InChI Key | LMMKSIKDRVVLKF-UHFFFAOYSA-N |
| MDL Number | MFCD09041651 |
| Molecular Formula | C12H15NO |
| Molecular Weight | 189.2536 |
| SMILES | CCC1C2=C(C=CC=C2)OC=1C(N)C |
| Synonyms | 1-(3-ethyl-1-benzofuran-2-yl)ethan-1-amine,
926227-25-0,
AC1Q2T6K,
SCHEMBL4095188,
CTK6D0858,
AKOS000123688,
AKOS022474676,
NE57081,
EN300-51328,
|
| Complexity | 195 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.258g/mol |
| Monoisotopic Mass | 189.115g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number