| CAS Number | 1016161-31-1 |
| Catalog Number | AG01A4T0 |
| Chemical Name | 3-Cyclopropylprop-2-enenitrile |
| IUPAC Name | 3-cyclopropylprop-2-enenitrile |
| InChI | InChI=1S/C6H7N/c7-5-1-2-6-3-4-6/h1-2,6H,3-4H2 |
| InChI Key | AHJKTMQDOYBLSR-UHFFFAOYSA-N |
| MDL Number | MFCD16707059 |
| Molecular Formula | C6H7N |
| Molecular Weight | 93.1265 |
| SMILES | N#CC=CC1CC1 |
| Synonyms | 3-cyclopropylprop-2-enenitrile,
1016161-31-1,
3-cyclopropylacrylonitrile,
AHJKTMQDOYBLSR-UHFFFAOYSA-N,
AKOS017469801,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 93.058g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 93.129g/mol |
| Monoisotopic Mass | 93.058g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 23.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number