| CAS Number | 1179705-68-0 |
| Catalog Number | AG01A6A0(AGN-PC-0WO5N8) |
| Chemical Name | 2-amino-2-ethyl-3-methylbutanenitrile |
| IUPAC Name | 2-amino-2-ethyl-3-methylbutanenitrile |
| InChI | InChI=1S/C7H14N2/c1-4-7(9,5-8)6(2)3/h6H,4,9H2,1-3H3 |
| InChI Key | JOAWGWIRTJDOPT-UHFFFAOYSA-N |
| MDL Number | MFCD12807216 |
| Molecular Formula | C7H14N2 |
| Molecular Weight | 126.1995 |
| SMILES | CCC(C(C)C)(C#N)N |
| Synonyms | 2-amino-2-ethyl-3-methylbutanenitrile,
1179705-68-0,
MFCD12807216,
AKOS010149241,
NE37154,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 126.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 126.203g/mol |
| Monoisotopic Mass | 126.116g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number