| CAS Number | 1170900-73-8 |
| Catalog Number | AG019MA8 |
| Chemical Name | 4-(4-tert-Butylphenyl)-2-chloroaniline hydrochloride |
| IUPAC Name | 4-(4-tert-butylphenyl)-2-chloroaniline;hydrochloride |
| InChI | InChI=1S/C16H18ClN.ClH/c1-16(2,3)13-7-4-11(5-8-13)12-6-9-15(18)14(17)10-12;/h4-10H,18H2,1-3H3;1H |
| InChI Key | WHZPAJXYAVYTGU-UHFFFAOYSA-N |
| MDL Number | MFCD10686705 |
| Molecular Formula | C16H19Cl2N |
| Molecular Weight | 296.2348 |
| SMILES | Cl.CC(C1=CC=C(C2=CC(Cl)=C(N)C=C2)C=C1)(C)C |
| Synonyms | 1170900-73-8,
4-(4-tert-butylphenyl)-2-chloroaniline hydrochloride,
4'-tert-butyl-3-chloro-1,1'-biphenyl-4-amine hydrochloride,
AC1Q38YR,
CTK7D8099,
AKOS030690012,
MCULE-3727143783,
NE48579,
EN300-35580,
Z367452194,
4'-tert-butyl-3-chloro-[1,1'-biphenyl]-4-amine hydrochloride,
|
| Complexity | 263 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 295.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 296.235g/mol |
| Monoisotopic Mass | 295.089g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number