| CAS Number | 50742-34-2 |
| Catalog Number | AG01C3Y2(AGN-PC-0JNLES) |
| Chemical Name | 4-methanesulfonylbutan-1-amine hydrochloride |
| IUPAC Name | 4-methylsulfonylbutan-1-amine;hydrochloride |
| InChI | InChI=1S/C5H13NO2S.ClH/c1-9(7,8)5-3-2-4-6;/h2-6H2,1H3;1H |
| InChI Key | WEDQZFQZBYGHGV-UHFFFAOYSA-N |
| MDL Number | MFCD29762928 |
| Molecular Formula | C5H14ClNO2S |
| Molecular Weight | 187.6882 |
| SMILES | Cl.CS(CCCCN)(=O)=O |
| Synonyms | methylsulfonylbutylamine,
Methylsulfonylbutylamine,
50742-34-2,
1-Butanamine, 4-(methylsulfonyl)-, hydrochloride,
4-METHANESULFONYLBUTAN-1-AMINE HYDROCHLORIDE,
AC1L4RYN,
AC1Q6TMD,
CTK4J3082,
DTXSID30198787,
4-methylsulfonylbutan-1-amine hydrochloride,
Z2379802695,
AR-1C2059,
CID191144,
5453-68-9,
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| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.682g/mol |
| Monoisotopic Mass | 187.043g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 68.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number