| CAS Number | 859791-59-6 |
| Catalog Number | AG019T28 |
| Chemical Name | 4-(Ethoxymethyl)aniline |
| IUPAC Name | 4-(ethoxymethyl)aniline |
| InChI | InChI=1S/C9H13NO/c1-2-11-7-8-3-5-9(10)6-4-8/h3-6H,2,7,10H2,1H3 |
| InChI Key | SJVXBSOZYHQKSR-UHFFFAOYSA-N |
| MDL Number | MFCD03787347 |
| Molecular Formula | C9H13NO |
| Molecular Weight | 151.2056 |
| SMILES | CCOCC1=CC=C(N)C=C1 |
| Synonyms | 4-(ETHOXYMETHYL)ANILINE,
859791-59-6,
[4-(ethoxymethyl)phenyl]amine,
SCHEMBL11367135,
CTK6G3613,
ZINC22204326,
AKOS000111355,
MCULE-4486009312,
NE43413,
J3.530.410J,
Z1276496840,
|
| Complexity | 97.7 |
| 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 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number