| CAS Number | 1184458-97-6 |
| Catalog Number | AG01EHTH |
| Chemical Name | ethyl(1-phenylpentan-2-yl)amine |
| IUPAC Name | N-ethyl-1-phenylpentan-2-amine |
| InChI | InChI=1S/C13H21N/c1-3-8-13(14-4-2)11-12-9-6-5-7-10-12/h5-7,9-10,13-14H,3-4,8,11H2,1-2H3 |
| InChI Key | LLTXYACYGSURSM-UHFFFAOYSA-N |
| MDL Number | MFCD12154202 |
| Molecular Formula | C13H21N |
| Molecular Weight | 191.3125 |
| SMILES | CCCC(NCC)CC1=CC=CC=C1 |
| Synonyms | ethyl(1-phenylpentan-2-yl)amine,
1184458-97-6,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.167g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.318g/mol |
| Monoisotopic Mass | 191.167g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
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