| CAS Number | 35120-17-3 |
| Catalog Number | AG01B8XW(AGN-PC-0O97GA) |
| Chemical Name | 1-(methylsulfanyl)cyclobutane-1-carbaldehyde |
| IUPAC Name | 1-methylsulfanylcyclobutane-1-carbaldehyde |
| InChI | InChI=1S/C6H10OS/c1-8-6(5-7)3-2-4-6/h5H,2-4H2,1H3 |
| InChI Key | YTPDQYFMZLEAGP-UHFFFAOYSA-N |
| MDL Number | MFCD24679687 |
| Molecular Formula | C6H10OS |
| Molecular Weight | 130.2080 |
| SMILES | CSC1(C=O)CCC1 |
| Synonyms | 1-(methylsulfanyl)cyclobutane-1-carbaldehyde,
35120-17-3,
ZINC216162778,
|
| Complexity | 96.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 130.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 130.205g/mol |
| Monoisotopic Mass | 130.045g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number