| CAS Number | 130996-65-5 |
| Catalog Number | AG01AARA |
| Chemical Name | 2,6-Dimethylheptan-4-amine hydrochloride |
| IUPAC Name | 2,6-dimethylheptan-4-amine;hydrochloride |
| InChI | InChI=1S/C9H21N.ClH/c1-7(2)5-9(10)6-8(3)4;/h7-9H,5-6,10H2,1-4H3;1H |
| InChI Key | MIIOSNBDDPBLBR-UHFFFAOYSA-N |
| MDL Number | MFCD17480397 |
| Molecular Formula | C9H22ClN |
| Molecular Weight | 179.7307 |
| SMILES | CC(C)CC(CC(C)C)N.Cl |
| Synonyms | 2,6-dimethylheptan-4-amine hydrochloride,
130996-65-5,
SCHEMBL56763,
MIIOSNBDDPBLBR-UHFFFAOYSA-N,
AC1Q3920,
AKOS008110160,
MCULE-1554135812,
NE49060,
2,6-Dimethyl-4-aminoheptane Hydrochloride,
FT-0739849,
EN300-69361,
|
| Complexity | 66.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.144g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.732g/mol |
| Monoisotopic Mass | 179.144g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number