| CAS Number | 128899-92-3 |
| Catalog Number | AG01AINL |
| Chemical Name | (2-Amino-3-phenylpropyl)(methyl)amine |
| IUPAC Name | 1-N-methyl-3-phenylpropane-1,2-diamine |
| InChI | InChI=1S/C10H16N2/c1-12-8-10(11)7-9-5-3-2-4-6-9/h2-6,10,12H,7-8,11H2,1H3 |
| InChI Key | REGVHZUNENZGJG-UHFFFAOYSA-N |
| MDL Number | MFCD12796823 |
| Molecular Formula | C10H16N2 |
| Molecular Weight | 164.2474 |
| SMILES | CNCC(CC1=CC=CC=C1)N |
| Synonyms | (2-amino-3-phenylpropyl)(methyl)amine,
128899-92-3,
SCHEMBL3008240,
AKOS008147963,
MCULE-4291247711,
NE57798,
EN300-78467,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.252g/mol |
| Monoisotopic Mass | 164.131g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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Certificate of Analysis
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