| CAS Number | 1334146-65-4 |
| Catalog Number | AG01AJID(AGN-PC-0WO3TW) |
| Chemical Name | methyl[4-(methylsulfanyl)butan-2-yl]amine |
| IUPAC Name | N-methyl-4-methylsulfanylbutan-2-amine |
| InChI | InChI=1S/C6H15NS/c1-6(7-2)4-5-8-3/h6-7H,4-5H2,1-3H3 |
| InChI Key | MYFRYENLDLWAFX-UHFFFAOYSA-N |
| MDL Number | MFCD19686255 |
| Molecular Formula | C6H15NS |
| Molecular Weight | 133.2550 |
| SMILES | CNC(CCSC)C |
| Synonyms | methyl[4-(methylsulfanyl)butan-2-yl]amine,
1334146-65-4,
SCHEMBL10023025,
AKOS013601893,
NE27242,
EN300-80839,
|
| Complexity | 47.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 133.093g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 133.253g/mol |
| Monoisotopic Mass | 133.093g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number