| CAS Number | 143504-81-8 |
| Catalog Number | AG01A25G(AGN-PC-0038NQ) |
| Chemical Name | 3-(4-Methoxyphenyl)-2-methylpropane-1,2-diamine |
| IUPAC Name | 3-(4-methoxyphenyl)-2-methylpropane-1,2-diamine |
| InChI | InChI=1S/C11H18N2O/c1-11(13,8-12)7-9-3-5-10(14-2)6-4-9/h3-6H,7-8,12-13H2,1-2H3 |
| InChI Key | MDBPTEVGPIYLQS-UHFFFAOYSA-N |
| MDL Number | MFCD18306061 |
| Molecular Formula | C11H18N2O |
| Molecular Weight | 194.2734 |
| SMILES | COC1=CC=C(CC(CN)(N)C)C=C1 |
| Synonyms | 3-(4-methoxyphenyl)-2-methylpropane-1,2-diamine,
143504-81-8,
SCHEMBL9583292,
AKOS012576765,
MCULE-9331836819,
NE21560,
DB-098922,
1-Methyl-1-(4-methoxybenzyl)-1,2-ethanediamine,
Z1495385317,
|
| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.141913g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.27g/mol |
| Monoisotopic Mass | 194.141913g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 61.3Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number