| CAS Number | 867329-97-3 |
| Catalog Number | AG019OLE(AGN-PC-0WOC8M) |
| Chemical Name | 3-(1-Phenylethoxy)propan-1-amine |
| IUPAC Name | 3-(1-phenylethoxy)propan-1-amine |
| InChI | InChI=1S/C11H17NO/c1-10(13-9-5-8-12)11-6-3-2-4-7-11/h2-4,6-7,10H,5,8-9,12H2,1H3 |
| InChI Key | FTIIDZXBKULXCC-UHFFFAOYSA-N |
| MDL Number | MFCD07339538 |
| Molecular Formula | C11H17NO |
| Molecular Weight | 179.2588 |
| SMILES | CC(C1=CC=CC=C1)OCCCN |
| Synonyms | 3-(1-phenylethoxy)propan-1-amine,
867329-97-3,
AC1Q2C3H,
CTK7E8478,
HMS1741N17,
AKOS000201114,
AKOS017277100,
MCULE-4762195303,
NE13555,
EN300-14387,
Z99601222,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.263g/mol |
| Monoisotopic Mass | 179.131g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number