| CAS Number | 147724-88-7 |
| Catalog Number | AG019W7V(AGN-PC-0Q0SOQ) |
| Chemical Name | 1-(3-methyl-1-benzofuran-2-yl)ethan-1-amine |
| IUPAC Name | 1-(3-methyl-1-benzofuran-2-yl)ethanamine |
| InChI | InChI=1S/C11H13NO/c1-7-9-5-3-4-6-10(9)13-11(7)8(2)12/h3-6,8H,12H2,1-2H3 |
| InChI Key | RPFUXVGRERMSGL-UHFFFAOYSA-N |
| MDL Number | MFCD09041841 |
| Molecular Formula | C11H13NO |
| Molecular Weight | 175.2270 |
| SMILES | CC(C1=C(C)C2=C(C=CC=C2)O1)N |
| Synonyms | 1-(3-methyl-1-benzofuran-2-yl)ethan-1-amine,
147724-88-7,
AC1Q2B6A,
SCHEMBL4092984,
CTK6A6188,
AKOS000124226,
MCULE-1808832461,
NE38342,
EN300-50978,
AB00997251-01,
|
| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.231g/mol |
| Monoisotopic Mass | 175.1g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number