| CAS Number | 1242240-28-3 |
| Catalog Number | AG00J2BU(AGN-PC-0WB6NL) |
| Chemical Name | N,N-dimethylazepan-4-amine dihydrochloride |
| IUPAC Name | N,N-dimethylazepan-4-amine;dihydrochloride |
| InChI | InChI=1S/C8H18N2.2ClH/c1-10(2)8-4-3-6-9-7-5-8;;/h8-9H,3-7H2,1-2H3;2*1H |
| InChI Key | QHQSVMWUYQRAFO-UHFFFAOYSA-N |
| MDL Number | MFCD22666524 |
| Molecular Formula | C8H20Cl2N2 |
| Molecular Weight | 215.1638 |
| SMILES | N1CCCC(CC1)N(C)C.Cl.Cl |
| Synonyms | 1242240-28-3,
N,N-Dimethyl-4-azepanamine dihydrochloride,
N,N-Dimethylazepan-4-amine dihydrochloride,
ZX-CM008944,
MFCD22666524,
AKOS026742366,
EN300-181443,
N,N-Dimethyl-4-azepanamine dihydrochloride, AldrichCPR,
N,N-dimethylazepan-4-amine 2hcl,
|
| Complexity | 91.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.162g/mol |
| Monoisotopic Mass | 214.1g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number