| CAS Number | 1017090-31-1 |
| Catalog Number | AG019KYW(AGN-PC-0WO9DS) |
| Chemical Name | 2-bromo-N-cyclopentyl-3-methylbutanamide |
| IUPAC Name | 2-bromo-N-cyclopentyl-3-methylbutanamide |
| InChI | InChI=1S/C10H18BrNO/c1-7(2)9(11)10(13)12-8-5-3-4-6-8/h7-9H,3-6H2,1-2H3,(H,12,13) |
| InChI Key | WJGPMEBCUHKVLX-UHFFFAOYSA-N |
| MDL Number | MFCD01070281 |
| Molecular Formula | C10H18BrNO |
| Molecular Weight | 248.1600 |
| SMILES | CC(C(C(NC1CCCC1)=O)Br)C |
| Synonyms | 2-bromo-N-cyclopentyl-3-methylbutanamide,
1017090-31-1,
AKOS000171080,
AKOS022340851,
NE31315,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 247.057g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 248.164g/mol |
| Monoisotopic Mass | 247.057g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number