| CAS Number | 23527-93-7 |
| Catalog Number | AG01A4DN(AGN-PC-0WO4GU) |
| Chemical Name | 4-ethyl-6-(methylsulfanyl)-1,3,5-triazin-2-amine |
| IUPAC Name | 4-ethyl-6-methylsulfanyl-1,3,5-triazin-2-amine |
| InChI | InChI=1S/C6H10N4S/c1-3-4-8-5(7)10-6(9-4)11-2/h3H2,1-2H3,(H2,7,8,9,10) |
| InChI Key | NSMIVJRFCKTAGS-UHFFFAOYSA-N |
| MDL Number | MFCD20706273 |
| Molecular Formula | C6H10N4S |
| Molecular Weight | 170.2354 |
| SMILES | CCC1=NC(SC)=NC(N)=N1 |
| Synonyms | 4-ethyl-6-(methylsulfanyl)-1,3,5-triazin-2-amine,
23527-93-7,
ZINC72417650,
AKOS015868236,
MCULE-8610042604,
NE19406,
Z1558774732,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.234g/mol |
| Monoisotopic Mass | 170.063g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 90A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
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Certificate of Analysis
Lot Number