| CAS Number | 131027-12-8 |
| Catalog Number | AG01B9MB(AGN-PC-0O0Z9A) |
| Chemical Name | 2-(methyldisulfanyl)ethan-1-amine hydrochloride |
| IUPAC Name | 2-(methyldisulfanyl)ethanamine;hydrochloride |
| InChI | InChI=1S/C3H9NS2.ClH/c1-5-6-3-2-4;/h2-4H2,1H3;1H |
| InChI Key | XPSDIJICFDWRBV-UHFFFAOYSA-N |
| MDL Number | MFCD28383925 |
| Molecular Formula | C3H10ClNS2 |
| Molecular Weight | 159.7012 |
| SMILES | Cl.CSSCCN |
| Synonyms | 2-(methyldisulfanyl)ethan-1-amine hydrochloride,
131027-12-8,
SCHEMBL3896193,
XPSDIJICFDWRBV-UHFFFAOYSA-N,
methyldithioethylamine hydrochloride,
|
| Complexity | 24.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 158.994g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.69g/mol |
| Monoisotopic Mass | 158.994g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 76.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number