| CAS Number | 19103-13-0 |
| Catalog Number | AG01AUGE |
| Chemical Name | 3-(dimethylamino)-2-methyl-2-phenylpropanal hydrochloride |
| IUPAC Name | 3-(dimethylamino)-2-methyl-2-phenylpropanal;hydrochloride |
| InChI | InChI=1S/C12H17NO.ClH/c1-12(10-14,9-13(2)3)11-7-5-4-6-8-11;/h4-8,10H,9H2,1-3H3;1H |
| InChI Key | BCCDCBXPSRTAPT-UHFFFAOYSA-N |
| MDL Number | MFCD29034880 |
| Molecular Formula | C12H18ClNO |
| Molecular Weight | 227.7304 |
| SMILES | Cl.CN(CC(C1=CC=CC=C1)(C=O)C)C |
| Synonyms | 19103-13-0,
3-(dimethylamino)-2-methyl-2-phenylpropanal hydrochloride,
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.732g/mol |
| Monoisotopic Mass | 227.108g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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