| CAS Number | 946761-13-3 |
| Catalog Number | AG01AD4Z(AGN-PC-0WO3S4) |
| Chemical Name | 5-Chloro-2-(cyclopentyloxy)aniline |
| IUPAC Name | 5-chloro-2-cyclopentyloxyaniline |
| InChI | InChI=1S/C11H14ClNO/c12-8-5-6-11(10(13)7-8)14-9-3-1-2-4-9/h5-7,9H,1-4,13H2 |
| InChI Key | HRWLBPIQTDNNBO-UHFFFAOYSA-N |
| MDL Number | MFCD11127450 |
| Molecular Formula | C11H14ClNO |
| Molecular Weight | 211.6880 |
| SMILES | NC1=C(OC2CCCC2)C=CC(Cl)=C1 |
| Synonyms | 5-chloro-2-(cyclopentyloxy)aniline,
946761-13-3,
ZINC8730368,
AKOS000100890,
MCULE-7493378225,
NE24548,
Z274542098,
|
| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.689g/mol |
| Monoisotopic Mass | 211.076g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number