| CAS Number | 1777430-74-6 |
| Catalog Number | AG01C0IP |
| Chemical Name | 2-[benzyl(methyl)amino]-5-chlorobenzaldehyde |
| IUPAC Name | 2-[benzyl(methyl)amino]-5-chlorobenzaldehyde |
| InChI | InChI=1S/C15H14ClNO/c1-17(10-12-5-3-2-4-6-12)15-8-7-14(16)9-13(15)11-18/h2-9,11H,10H2,1H3 |
| InChI Key | UXLOCGUNXJIMAB-UHFFFAOYSA-N |
| MDL Number | MFCD30498017 |
| Molecular Formula | C15H14ClNO |
| Molecular Weight | 259.7308 |
| SMILES | CN(C1=C(C=O)C=C(Cl)C=C1)CC1=CC=CC=C1 |
| Synonyms | 2-[benzyl(methyl)amino]-5-chlorobenzaldehyde,
1777430-74-6,
AKOS033980409,
ZINC161192925,
Z2687578702,
|
| Complexity | 265 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 259.733g/mol |
| Monoisotopic Mass | 259.076g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
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Certificate of Analysis
Lot Number