| CAS Number | 1157089-61-6 |
| Catalog Number | AG019T4P |
| Chemical Name | 3-[(2-ethoxyethoxy)methyl]-2-methylaniline |
| IUPAC Name | 3-(2-ethoxyethoxymethyl)-2-methylaniline |
| InChI | InChI=1S/C12H19NO2/c1-3-14-7-8-15-9-11-5-4-6-12(13)10(11)2/h4-6H,3,7-9,13H2,1-2H3 |
| InChI Key | JTVIXLMAYVXQCP-UHFFFAOYSA-N |
| MDL Number | MFCD12186479 |
| Molecular Formula | C12H19NO2 |
| Molecular Weight | 209.2848 |
| SMILES | CCOCCOCC1=C(C)C(N)=CC=C1 |
| Synonyms | 3-[(2-ethoxyethoxy)methyl]-2-methylaniline,
1157089-61-6,
ZINC35649392,
AKOS009537894,
MCULE-9778969289,
NE35129,
Z1516118969,
|
| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.289g/mol |
| Monoisotopic Mass | 209.142g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number