| CAS Number | 171847-70-4 |
| Catalog Number | AG019SJY |
| Chemical Name | 2-(4-chlorophenoxy)propan-1-amine |
| IUPAC Name | 2-(4-chlorophenoxy)propan-1-amine |
| InChI | InChI=1S/C9H12ClNO/c1-7(6-11)12-9-4-2-8(10)3-5-9/h2-5,7H,6,11H2,1H3 |
| InChI Key | UCZNOIBVNALPSU-UHFFFAOYSA-N |
| MDL Number | MFCD07374145 |
| Molecular Formula | C9H12ClNO |
| Molecular Weight | 185.6507 |
| SMILES | CC(OC1=CC=C(Cl)C=C1)CN |
| Synonyms | 171847-70-4,
1-[(1-AMINOPROPAN-2-YL)OXY]-4-CHLOROBENZENE,
2-(4-chlorophenoxy)propan-1-amine,
2-(4-CHLOROPHENOXY)-1-PROPANAMINE,
2-(4-chlorophenoxy)propylamine,
STL218200,
AKOS010957991,
AB38863,
MCULE-5946279815,
NE21651,
ST45241831,
EN300-93935,
Z1269702201,
|
| Complexity | 124 |
| 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 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number