| CAS Number | 1311315-22-6 |
| Catalog Number | AG01AHJC |
| Chemical Name | (2-methylpropyl)(1-phenylpropyl)amine hydrochloride |
| IUPAC Name | 2-methyl-N-(1-phenylpropyl)propan-1-amine;hydrochloride |
| InChI | InChI=1S/C13H21N.ClH/c1-4-13(14-10-11(2)3)12-8-6-5-7-9-12;/h5-9,11,13-14H,4,10H2,1-3H3;1H |
| InChI Key | LEHFIORVUPJRFN-UHFFFAOYSA-N |
| MDL Number | MFCD18785492 |
| Molecular Formula | C13H22ClN |
| Molecular Weight | 227.7735 |
| SMILES | Cl.CCC(C1=CC=CC=C1)NCC(C)C |
| Synonyms | (2-methylpropyl)(1-phenylpropyl)amine hydrochloride,
1311315-22-6,
AKOS016904276,
MCULE-8578984843,
NE34845,
EN300-74924,
Z1171716845,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.144g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.776g/mol |
| Monoisotopic Mass | 227.144g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number