| CAS Number | 941400-59-5 |
| Catalog Number | AG019KW5(AGN-PC-0WO7KP) |
| Chemical Name | (1-amino-3-ethylpentan-2-yl)dimethylamine |
| IUPAC Name | 3-ethyl-2-N,2-N-dimethylpentane-1,2-diamine |
| InChI | InChI=1S/C9H22N2/c1-5-8(6-2)9(7-10)11(3)4/h8-9H,5-7,10H2,1-4H3 |
| InChI Key | KSMHCPGLPFFCFA-UHFFFAOYSA-N |
| MDL Number | MFCD09413279 |
| Molecular Formula | C9H22N2 |
| Molecular Weight | 158.2844 |
| SMILES | CCC(C(N(C)C)CN)CC |
| Synonyms | (1-amino-3-ethylpentan-2-yl)dimethylamine,
941400-59-5,
N-[1-(aminomethyl)-2-ethylbutyl]-N,N-dimethylamine,
AC1Q2SEW,
CTK6C7790,
AKOS000200747,
AKOS016053515,
MCULE-5650245049,
NE14270,
EN300-28775,
F2186-0056,
Z228574274,
|
| Complexity | 87.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 158.178g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 158.289g/mol |
| Monoisotopic Mass | 158.178g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number