| CAS Number | 1019568-17-2 |
| Catalog Number | AG009472(AGN-PC-0WRA40) |
| Chemical Name | 3-(Cyclopropylmethoxy)propanenitrile |
| IUPAC Name | 3-(cyclopropylmethoxy)propanenitrile |
| InChI | InChI=1S/C7H11NO/c8-4-1-5-9-6-7-2-3-7/h7H,1-3,5-6H2 |
| InChI Key | ORJJJDKPWWVKSY-UHFFFAOYSA-N |
| MDL Number | MFCD11136705 |
| Molecular Formula | C7H11NO |
| Molecular Weight | 125.1683 |
| SMILES | N#CCCOCC1CC1 |
| Synonyms | 3-(cyclopropylmethoxy)propanenitrile,
1019568-17-2,
KM4057,
ZINC19870800,
AKOS000221502,
CJ-16472,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 125.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 125.171g/mol |
| Monoisotopic Mass | 125.084g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 33A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number