| CAS Number | 1306225-07-9 |
| Catalog Number | AG01AIAT |
| Chemical Name | [(2,4-Dichlorophenyl)(pyridin-3-yl)methyl](methyl)amine |
| IUPAC Name | 1-(2,4-dichlorophenyl)-N-methyl-1-pyridin-3-ylmethanamine |
| InChI | InChI=1S/C13H12Cl2N2/c1-16-13(9-3-2-6-17-8-9)11-5-4-10(14)7-12(11)15/h2-8,13,16H,1H3 |
| InChI Key | HEDJEUMBKXDANM-UHFFFAOYSA-N |
| MDL Number | MFCD13328274 |
| Molecular Formula | C13H12Cl2N2 |
| Molecular Weight | 267.1538 |
| SMILES | CNC(C1=C(Cl)C=C(Cl)C=C1)C1=CN=CC=C1 |
| Synonyms | [(2,4-dichlorophenyl)(pyridin-3-yl)methyl](methyl)amine,
1306225-07-9,
AKOS033212177,
MCULE-3789956558,
NE51081,
EN300-77250,
Z1267881730,
|
| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 266.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.153g/mol |
| Monoisotopic Mass | 266.038g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
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Certificate of Analysis
Lot Number