| CAS Number | 640766-50-3 |
| Catalog Number | AG01A7S2 |
| Chemical Name | N-methyl-2-phenoxyaniline |
| IUPAC Name | N-methyl-2-phenoxyaniline |
| InChI | InChI=1S/C13H13NO/c1-14-12-9-5-6-10-13(12)15-11-7-3-2-4-8-11/h2-10,14H,1H3 |
| InChI Key | KWLMNTMQLZGMDL-UHFFFAOYSA-N |
| MDL Number | MFCD11151225 |
| Molecular Formula | C13H13NO |
| Molecular Weight | 199.2484 |
| SMILES | CNC1=C(OC2=CC=CC=C2)C=CC=C1 |
| Synonyms | N-methyl-2-phenoxyaniline,
640766-50-3,
AC1Q40WM,
SCHEMBL1341786,
CTK6I4943,
KWLMNTMQLZGMDL-UHFFFAOYSA-N,
ZINC20041614,
AKOS000252394,
MCULE-6869505752,
NE15005,
EN300-59643,
Z969563030,
|
| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.253g/mol |
| Monoisotopic Mass | 199.1g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number