| CAS Number | 66896-49-9 |
| Catalog Number | AG01B9FV(AGN-PC-0TMG4J) |
| Chemical Name | Methyl(2-phenylpropan-2-yl)amine |
| IUPAC Name | N-methyl-2-phenylpropan-2-amine |
| InChI | InChI=1S/C10H15N/c1-10(2,11-3)9-7-5-4-6-8-9/h4-8,11H,1-3H3 |
| InChI Key | KLNAMUMXXCWVAL-UHFFFAOYSA-N |
| MDL Number | MFCD28383859 |
| Molecular Formula | C10H15N |
| Molecular Weight | 149.2328 |
| SMILES | CNC(C)(C)C1=CC=CC=C1 |
| Synonyms | methyl(2-phenylpropan-2-yl)amine,
66896-49-9,
phenisopropyl methyl amine,
SCHEMBL663244,
SCHEMBL7997234,
1,N-Dimethyl-1-phenylethanamine,
N-methyl-2-phenylpropan-2-amine,
KLNAMUMXXCWVAL-UHFFFAOYSA-N,
ZINC39434355,
AKOS006237688,
Z991114970,
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| Complexity | 112 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.120449g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 149.23g/mol |
| Monoisotopic Mass | 149.120449g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
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