| CAS Number | 2486-64-8 |
| Catalog Number | AG01ADLA(AGN-PC-0JPF64) |
| Chemical Name | 3-Ethoxy-4-methylaniline |
| IUPAC Name | 3-ethoxy-4-methylaniline |
| InChI | InChI=1S/C9H13NO/c1-3-11-9-6-8(10)5-4-7(9)2/h4-6H,3,10H2,1-2H3 |
| InChI Key | OKFMXCNYDJVSNP-UHFFFAOYSA-N |
| MDL Number | MFCD11934371 |
| Molecular Formula | C9H13NO |
| Molecular Weight | 151.2056 |
| NSC Number | 166391 |
| SMILES | CCOC1=C(C)C=CC(N)=C1 |
| Synonyms | 3-ethoxy-4-methylaniline,
2486-64-8,
NSC166391,
3-Ethoxy-p-toluidine,
AC1L6PYL,
3-(ethyloxy)-4-methylaniline,
SCHEMBL1188568,
DTXSID10304586,
Benzenamine, 3-ethoxy-4-methyl-,
OKFMXCNYDJVSNP-UHFFFAOYSA-N,
ZINC1655662,
AKOS009546970,
MCULE-8846029178,
NSC-166391,
A1-02936,
CID296323,
N/A,
|
| Complexity | 116 |
| 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 | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number