| CAS Number | 599163-84-5 |
| Catalog Number | AG01ELRF |
| Chemical Name | N-(3-chloropropyl)-2-ethylbutanamide |
| IUPAC Name | N-(3-chloropropyl)-2-ethylbutanamide |
| InChI | InChI=1S/C9H18ClNO/c1-3-8(4-2)9(12)11-7-5-6-10/h8H,3-7H2,1-2H3,(H,11,12) |
| InChI Key | ANOCSBSJIRPSCQ-UHFFFAOYSA-N |
| MDL Number | MFCD03638133 |
| Molecular Formula | C9H18ClNO |
| Molecular Weight | 191.6983 |
| SMILES | CCC(C(NCCCCl)=O)CC |
| Synonyms | N-(3-chloropropyl)-2-ethylbutanamide,
AC1NCHEV,
599163-84-5,
CID4533769,
N-(3-chloropropyl)-2-ethyl-butanamide,
|
| Complexity | 124 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.699g/mol |
| Monoisotopic Mass | 191.108g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number