| CAS Number | 1936174-22-9 |
| Catalog Number | AG01C3LE |
| Chemical Name | 1-(bromomethyl)cyclopentane-1-carbonitrile |
| IUPAC Name | 1-(bromomethyl)cyclopentane-1-carbonitrile |
| InChI | InChI=1S/C7H10BrN/c8-5-7(6-9)3-1-2-4-7/h1-5H2 |
| InChI Key | RBFFITHVQYTUBF-UHFFFAOYSA-N |
| MDL Number | MFCD29991289 |
| Molecular Formula | C7H10BrN |
| Molecular Weight | 188.065 |
| SMILES | BrCC1(C#N)CCCC1 |
| Synonyms | 1-(bromomethyl)cyclopentane-1-carbonitrile,
1936174-22-9,
ZINC307064063,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.068g/mol |
| Monoisotopic Mass | 187g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 23.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number