| CAS Number | 36323-70-3 |
| Catalog Number | AG00I77K(AGN-PC-0WQVOC) |
| Chemical Name | 4-chloro-N,N-dimethyl-6-phenyl-1,3,5-triazin-2-amine |
| IUPAC Name | 4-chloro-N,N-dimethyl-6-phenyl-1,3,5-triazin-2-amine |
| InChI | InChI=1S/C11H11ClN4/c1-16(2)11-14-9(13-10(12)15-11)8-6-4-3-5-7-8/h3-7H,1-2H3 |
| InChI Key | ZZWOGAHPXAPUSB-UHFFFAOYSA-N |
| MDL Number | MFCD21276137 |
| Molecular Formula | C11H11ClN4 |
| Molecular Weight | 234.6848 |
| SMILES | CN(C)c1nc(Cl)nc(n1)-c1ccccc1 |
| Synonyms | 4-chloro-N,N-dimethyl-6-phenyl-1,3,5-triazin-2-amine,
36323-70-3,
SCHEMBL19295118,
MFCD21276137,
ZINC84025224,
AKOS014984316,
TZ000627,
CS-0035600,
4-chloro-2-dimethylamino-6-phenyl-1,3,5-triazine,
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| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.687g/mol |
| Monoisotopic Mass | 234.067g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 41.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
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Certificate of Analysis
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