| CAS Number | 1539572-09-2 |
| Catalog Number | AG01C0AK |
| Chemical Name | 6-(propylsulfanyl)pyridin-2-amine |
| IUPAC Name | 6-propylsulfanylpyridin-2-amine |
| InChI | InChI=1S/C8H12N2S/c1-2-6-11-8-5-3-4-7(9)10-8/h3-5H,2,6H2,1H3,(H2,9,10) |
| InChI Key | ZOJNADBPRTYGGI-UHFFFAOYSA-N |
| MDL Number | MFCD23956205 |
| Molecular Formula | C8H12N2S |
| Molecular Weight | 168.2593 |
| SMILES | CCCSC1=NC(N)=CC=C1 |
| Synonyms | 6-(propylsulfanyl)pyridin-2-amine,
1539572-09-2,
ZINC87731984,
AKOS019219825,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.258g/mol |
| Monoisotopic Mass | 168.072g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 64.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number