| CAS Number | 1019596-43-0 |
| Catalog Number | AG01AXML |
| Chemical Name | (1-phenylpropyl)(propan-2-yl)amine |
| IUPAC Name | 1-phenyl-N-propan-2-ylpropan-1-amine |
| InChI | InChI=1S/C12H19N/c1-4-12(13-10(2)3)11-8-6-5-7-9-11/h5-10,12-13H,4H2,1-3H3 |
| InChI Key | UIRHNVZMIFRCLF-UHFFFAOYSA-N |
| MDL Number | MFCD11139183 |
| Molecular Formula | C12H19N |
| Molecular Weight | 177.2860 |
| SMILES | CCC(C1=CC=CC=C1)NC(C)C |
| Synonyms | Isopropyl-(1-phenyl-propyl)-amine,
1019596-43-0,
N-Isopropyl-1-phenylpropan-1-amine,
Isopropyl (1-phenylpropyl)amine,
SCHEMBL13302608,
(1-phenylpropyl)(propan-2-yl)amine,
AKOS000228680,
AM90447,
|
| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.291g/mol |
| Monoisotopic Mass | 177.152g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number