| CAS Number | 1100753-12-5 |
| Catalog Number | AG01AJF7(AGN-PC-0WQVM8) |
| Chemical Name | Tetrahydrofuran-2-carbothioamide |
| IUPAC Name | oxolane-2-carbothioamide |
| InChI | InChI=1S/C5H9NOS/c6-5(8)4-2-1-3-7-4/h4H,1-3H2,(H2,6,8) |
| InChI Key | DSOJWOBEFDFZNV-UHFFFAOYSA-N |
| MDL Number | MFCD05662455 |
| Molecular Formula | C5H9NOS |
| Molecular Weight | 131.1961 |
| SMILES | NC(C1OCCC1)=S |
| Synonyms | oxolane-2-carbothioamide,
1100753-12-5,
Tetrahydrofuran-2-carbothioamide,
TETRAHYDRO-FURAN-2-CARBOTHIOIC ACID AMIDE,
tetrahydro- 2-Furancarbothioamide,
SCHEMBL7818190,
AC1Q5009,
MFCD05662455,
AKOS006295718,
NE18553,
EN300-80576,
662T455,
|
| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 131.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 131.193g/mol |
| Monoisotopic Mass | 131.04g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 67.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number