| CAS Number | 80171-91-1 |
| Catalog Number | AG019V1B |
| Chemical Name | 2-(Ethoxymethyl)aniline |
| IUPAC Name | 2-(ethoxymethyl)aniline |
| InChI | InChI=1S/C9H13NO/c1-2-11-7-8-5-3-4-6-9(8)10/h3-6H,2,7,10H2,1H3 |
| InChI Key | DURIMTJCKALZNT-UHFFFAOYSA-N |
| MDL Number | MFCD09814585 |
| Molecular Formula | C9H13NO |
| Molecular Weight | 151.2056 |
| SMILES | CCOCC1=C(N)C=CC=C1 |
| Synonyms | 2-(ethoxymethyl)aniline,
80171-91-1,
o-Aminobenzyl-Athylather,
SCHEMBL7689047,
CTK6G3624,
AC1Q3867,
ZINC13346819,
AKOS000157279,
MCULE-8410140912,
NE48737,
EN300-43444,
|
| Complexity | 106 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 151.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 151.209g/mol |
| Monoisotopic Mass | 151.1g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number