| CAS Number | 1221726-24-4 |
| Catalog Number | AG01A7MI(AGN-PC-0WOUAF) |
| Chemical Name | 2-(Prop-2-en-1-ylsulfanyl)ethan-1-amine hydrochloride |
| IUPAC Name | 2-prop-2-enylsulfanylethanamine;hydrochloride |
| InChI | InChI=1S/C5H11NS.ClH/c1-2-4-7-5-3-6;/h2H,1,3-6H2;1H |
| InChI Key | RHADQXRAYRUCIA-UHFFFAOYSA-N |
| MDL Number | MFCD03161183 |
| Molecular Formula | C5H12ClNS |
| Molecular Weight | 153.6735 |
| SMILES | Cl.NCCSCC=C |
| Synonyms | 2-(prop-2-en-1-ylsulfanyl)ethan-1-amine hydrochloride,
1221726-24-4,
AC1Q3DFK,
SCHEMBL8604712,
CTK7E9485,
AKOS026743687,
MCULE-9922932955,
NE58839,
EN300-59170,
A1-06074,
Z1262237162,
allyl 2-aminoethyl sulfide,
|
| Complexity | 45.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.668g/mol |
| Monoisotopic Mass | 153.038g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 51.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number