| CAS Number | 183162-37-0 |
| Catalog Number | AG01AP0M(AGN-PC-03KW6E) |
| Chemical Name | 3-Hydroxyoxolane-3-carbonitrile |
| IUPAC Name | 3-hydroxyoxolane-3-carbonitrile |
| InChI | InChI=1S/C5H7NO2/c6-3-5(7)1-2-8-4-5/h7H,1-2,4H2 |
| InChI Key | ZWPMBJQNZNDJDU-UHFFFAOYSA-N |
| MDL Number | MFCD18333805 |
| Molecular Formula | C5H7NO2 |
| Molecular Weight | 113.1146 |
| SMILES | N#CC1(O)COCC1 |
| Synonyms | 3-hydroxyoxolane-3-carbonitrile,
183162-37-0,
SCHEMBL5692325,
AKOS012637534,
|
| Complexity | 137 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 113.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 113.116g/mol |
| Monoisotopic Mass | 113.048g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 53.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number