| CAS Number | 105340-56-5 |
| Catalog Number | AG019WV4(AGN-PC-0WOCPQ) |
| Chemical Name | [1-(1-benzofuran-2-yl)ethyl](ethyl)amine |
| IUPAC Name | 1-(1-benzofuran-2-yl)-N-ethylethanamine |
| InChI | InChI=1S/C12H15NO/c1-3-13-9(2)12-8-10-6-4-5-7-11(10)14-12/h4-9,13H,3H2,1-2H3 |
| InChI Key | XLCDXJDKWGOIPA-UHFFFAOYSA-N |
| MDL Number | MFCD09949206 |
| Molecular Formula | C12H15NO |
| Molecular Weight | 189.2536 |
| SMILES | CCNC(C1OC2=C(C=CC=C2)C=1)C |
| Synonyms | [1-(1-benzofuran-2-yl)ethyl](ethyl)amine,
105340-56-5,
AC1Q31ET,
AKOS000192200,
AKOS022478268,
MCULE-2462869832,
NE29434,
EN300-53236,
|
| Complexity | 183 |
| 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 | 3 |
| Topological Polar Surface Area | 25.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number