| CAS Number | 948572-70-1 |
| Catalog Number | AG01C2LC |
| Chemical Name | 4-[(Dimethylamino)methyl]-3-methylaniline |
| IUPAC Name | 4-[(dimethylamino)methyl]-3-methylaniline |
| InChI | InChI=1S/C10H16N2/c1-8-6-10(11)5-4-9(8)7-12(2)3/h4-6H,7,11H2,1-3H3 |
| InChI Key | LWVJANMCUNEPPA-UHFFFAOYSA-N |
| MDL Number | MFCD20725818 |
| Molecular Formula | C10H16N2 |
| Molecular Weight | 164.2474 |
| SMILES | CN(CC1=C(C)C=C(N)C=C1)C |
| Synonyms | 4-[(dimethylamino)methyl]-3-methylaniline,
948572-70-1,
Benzenemethanamine, 4-amino-N,N,2-trimethyl-,
SCHEMBL2174004,
ZINC118226711,
|
| Complexity | 134 |
| 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 | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.252g/mol |
| Monoisotopic Mass | 164.131g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number