| CAS Number | 1052550-44-3 |
| Catalog Number | AG00HAMC(AGN-PC-0WR4KB) |
| Chemical Name | N-(2-Methoxy-5-methylbenzyl)-n-methylamine, HCl |
| IUPAC Name | 1-(2-methoxy-5-methylphenyl)-N-methylmethanamine;hydrochloride |
| InChI | InChI=1S/C10H15NO.ClH/c1-8-4-5-10(12-3)9(6-8)7-11-2;/h4-6,11H,7H2,1-3H3;1H |
| InChI Key | ROQKTCVLSNLQNF-UHFFFAOYSA-N |
| MDL Number | MFCD07323323 |
| Molecular Formula | C10H16ClNO |
| Molecular Weight | 201.6931 |
| SMILES | Cl.CNCC1=C(OC)C=CC(C)=C1 |
| Synonyms | 1052550-44-3,
N-(2-methoxy-5-methylbenzyl)-N-methylamine hydrochloride,
[(2-methoxy-5-methylphenyl)methyl](methyl)amine hydrochloride,
EN300-13918,
AC1Q3BSF,
CTK6I5328,
MFCD07323323,
MCULE-5998837152,
NE62386,
N-(2-Methoxy-5-methylbenzyl)-n-methylamine, HCl,
Z94598686,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.694g/mol |
| Monoisotopic Mass | 201.092g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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