| CAS Number | 130566-25-5 |
| Catalog Number | AG019VRZ(AGN-PC-0WBVCS) |
| Chemical Name | 5-chloro-2-propoxyaniline |
| IUPAC Name | 5-chloro-2-propoxyaniline |
| InChI | InChI=1S/C9H12ClNO/c1-2-5-12-9-4-3-7(10)6-8(9)11/h3-4,6H,2,5,11H2,1H3 |
| InChI Key | UJEYTDFYQZDIKY-UHFFFAOYSA-N |
| MDL Number | MFCD04623503 |
| Molecular Formula | C9H12ClNO |
| Molecular Weight | 185.6507 |
| SMILES | CCCOC1=C(N)C=C(Cl)C=C1 |
| Synonyms | 5-chloro-2-propoxyaniline,
130566-25-5,
AC1Q2YBP,
SCHEMBL363534,
CTK6E6090,
Benzenamine, 5-chloro-2-propoxy-,
ZINC8730348,
AKOS000103060,
NE13974,
TR-046123,
BB 0254596,
EN300-48662,
N/A,
|
| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.651g/mol |
| Monoisotopic Mass | 185.061g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number