| CAS Number | 630125-41-6 |
| Catalog Number | AG01A8OP(AGN-PC-01N6F8) |
| Chemical Name | 3-Chloro-4-(pyridin-4-yloxy)aniline |
| IUPAC Name | 3-chloro-4-pyridin-4-yloxyaniline |
| InChI | InChI=1S/C11H9ClN2O/c12-10-7-8(13)1-2-11(10)15-9-3-5-14-6-4-9/h1-7H,13H2 |
| InChI Key | RFMXRAUSNODZKR-UHFFFAOYSA-N |
| MDL Number | MFCD11650979 |
| Molecular Formula | C11H9ClN2O |
| Molecular Weight | 220.6550 |
| SMILES | NC1=CC(Cl)=C(OC2=CC=NC=C2)C=C1 |
| Synonyms | 3-chloro-4-(pyridin-4-yloxy)aniline,
630125-41-6,
3-chloro-4-(pyridin-4-yloxy)phenylamine,
AC1Q51MM,
SCHEMBL631854,
ZINC36667266,
AKOS009394950,
MCULE-6214333461,
NE43680,
EN300-62186,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.656g/mol |
| Monoisotopic Mass | 220.04g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number