| CAS Number | 1334146-75-6 |
| Catalog Number | AG018SBY(AGN-PC-0WBPW2) |
| Chemical Name | 3-amino-4-(methylsulfanyl)butan-1-ol |
| IUPAC Name | 3-amino-4-methylsulfanylbutan-1-ol |
| InChI | InChI=1S/C5H13NOS/c1-8-4-5(6)2-3-7/h5,7H,2-4,6H2,1H3 |
| InChI Key | KLZAYMUKQIJPJV-UHFFFAOYSA-N |
| MDL Number | MFCD19982543 |
| Molecular Formula | C5H13NOS |
| Molecular Weight | 135.2278 |
| SMILES | CSCC(CCO)N |
| Synonyms | 3-amino-4-(methylsulfanyl)butan-1-ol,
1334146-75-6,
AKOS013709610,
NE37698,
EN300-83838,
F8889-7254,
|
| Complexity | 51.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 135.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 135.225g/mol |
| Monoisotopic Mass | 135.072g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 71.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number