| CAS Number | 2059975-62-9 |
| Catalog Number | AG01C0BW |
| Chemical Name | 3,4-dichloro-N-cyclopentylaniline hydrochloride |
| IUPAC Name | 3,4-dichloro-N-cyclopentylaniline;hydrochloride |
| InChI | InChI=1S/C11H13Cl2N.ClH/c12-10-6-5-9(7-11(10)13)14-8-3-1-2-4-8;/h5-8,14H,1-4H2;1H |
| InChI Key | QRPSCMFWZKJPLM-UHFFFAOYSA-N |
| MDL Number | MFCD30497917 |
| Molecular Formula | C11H14Cl3N |
| Molecular Weight | 266.5946 |
| SMILES | Cl.ClC1=C(Cl)C=C(NC2CCCC2)C=C1 |
| Synonyms | 3,4-dichloro-N-cyclopentylaniline hydrochloride,
2059975-62-9,
Z2738925488,
|
| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.019g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 266.59g/mol |
| Monoisotopic Mass | 265.019g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number