| CAS Number | 1044707-00-7 |
| Catalog Number | AG01E78A |
| Chemical Name | 2-(1,4-diazepan-1-yl)-N,N-dimethylacetamide dihydrochloride |
| IUPAC Name | 2-(1,4-diazepan-1-yl)-N,N-dimethylacetamide;dihydrochloride |
| InChI | InChI=1S/C9H19N3O.2ClH/c1-11(2)9(13)8-12-6-3-4-10-5-7-12;;/h10H,3-8H2,1-2H3;2*1H |
| InChI Key | AAHNKXZKCWODJY-UHFFFAOYSA-N |
| MDL Number | MFCD30752535 |
| Molecular Formula | C9H21Cl2N3O |
| Molecular Weight | 258.1885 |
| SMILES | Cl.Cl.CN(C(CN1CCNCCC1)=O)C |
| Synonyms | SCHEMBL2009563,
AAHNKXZKCWODJY-UHFFFAOYSA-N,
2-(1,4-Diazepan-1-yl)-N,N-dimethylacetamide dihydrochloride,
2-[1,4]Diazepan-1-yl-N,N-dimethyl-acetamide dihydrochloride,
1044707-00-7,
|
| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.187g/mol |
| Monoisotopic Mass | 257.106g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number