| CAS Number | 1181893-31-1 |
| Catalog Number | AG019WBT |
| Chemical Name | 2-chloro-N-[(4-chlorophenyl)methyl]aniline hydrochloride |
| IUPAC Name | 2-chloro-N-[(4-chlorophenyl)methyl]aniline;hydrochloride |
| InChI | InChI=1S/C13H11Cl2N.ClH/c14-11-7-5-10(6-8-11)9-16-13-4-2-1-3-12(13)15;/h1-8,16H,9H2;1H |
| InChI Key | GDNYSVSRXZLOIZ-UHFFFAOYSA-N |
| MDL Number | MFCD12912956 |
| Molecular Formula | C13H12Cl3N |
| Molecular Weight | 288.6001 |
| SMILES | Cl.ClC1=CC=C(CNC2=C(Cl)C=CC=C2)C=C1 |
| Synonyms | 2-chloro-N-[(4-chlorophenyl)methyl]aniline hydrochloride,
1181893-31-1,
AC1Q3B9A,
CTK6H0174,
AKOS008066667,
MCULE-9501698695,
NE19677,
EN300-51376,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 287.004g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 288.596g/mol |
| Monoisotopic Mass | 287.004g/mol |
| Rotatable Bond Count | 3 |
| 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