| CAS Number | 198226-66-3 |
| Catalog Number | AG01A2G1(AGN-PC-0QPQ0O) |
| Chemical Name | 1-(3-methoxyphenyl)-2-methylpropan-2-amine |
| IUPAC Name | 1-(3-methoxyphenyl)-2-methylpropan-2-amine |
| InChI | InChI=1S/C11H17NO/c1-11(2,12)8-9-5-4-6-10(7-9)13-3/h4-7H,8,12H2,1-3H3 |
| InChI Key | ADHRFCFPPSHSDD-UHFFFAOYSA-N |
| MDL Number | MFCD09888582 |
| Molecular Formula | C11H17NO |
| Molecular Weight | 179.2588 |
| SMILES | COC1=CC(CC(N)(C)C)=CC=C1 |
| Synonyms | 1-(3-methoxyphenyl)-2-methylpropan-2-amine,
198226-66-3,
SCHEMBL5222385,
ADHRFCFPPSHSDD-UHFFFAOYSA-N,
ZINC16786930,
AKOS011915057,
AB54582,
NE52071,
FT-0709113,
|
| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.263g/mol |
| Monoisotopic Mass | 179.131g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number