| CAS Number | 1221724-11-3 |
| Catalog Number | AG01A7M3 |
| Chemical Name | [4-(2,4-dichlorophenoxy)-3-methylphenyl]methanamine hydrochloride |
| IUPAC Name | [4-(2,4-dichlorophenoxy)-3-methylphenyl]methanamine;hydrochloride |
| InChI | InChI=1S/C14H13Cl2NO.ClH/c1-9-6-10(8-17)2-4-13(9)18-14-5-3-11(15)7-12(14)16;/h2-7H,8,17H2,1H3;1H |
| InChI Key | WDTRZPZOQHXRJK-UHFFFAOYSA-N |
| MDL Number | MFCD14705731 |
| Molecular Formula | C14H14Cl3NO |
| Molecular Weight | 318.6261 |
| SMILES | Cl.CC1=C(OC2=C(Cl)C=C(Cl)C=C2)C=CC(CN)=C1 |
| Synonyms | [4-(2,4-dichlorophenoxy)-3-methylphenyl]methanamine hydrochloride,
1221724-11-3,
AC1Q39DD,
AKOS008140815,
MCULE-2433215004,
NE44535,
EN300-59128,
|
| Complexity | 264 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 317.014g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 318.622g/mol |
| Monoisotopic Mass | 317.014g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number