| CAS Number | 39214-35-2 |
| Catalog Number | AG01DWEF(AGN-PC-002C9E) |
| Chemical Name | N-butyl-N-methylcarbamoyl chloride |
| IUPAC Name | N-butyl-N-methylcarbamoyl chloride |
| InChI | InChI=1S/C6H12ClNO/c1-3-4-5-8(2)6(7)9/h3-5H2,1-2H3 |
| InChI Key | CHGVIQWWXDOWRN-UHFFFAOYSA-N |
| MDL Number | MFCD19281932 |
| Molecular Formula | C6H12ClNO |
| Molecular Weight | 149.6186 |
| SMILES | CCCCN(C(Cl)=O)C |
| Synonyms | N-BUTYL-N-METHYLCARBAMOYL CHLORIDE,
39214-35-2,
N-n-butyl-N-methylcarbamoyl chloride,
SCHEMBL5286753,
AKOS017514277,
|
| Complexity | 95.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 149.618g/mol |
| Monoisotopic Mass | 149.061g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number