| CAS Number | 215509-45-8 |
| Catalog Number | AG01E7IA |
| Chemical Name | (prop-2-yn-1-yl)(propan-2-yl)amine hydrochloride |
| IUPAC Name | N-prop-2-ynylpropan-2-amine;hydrochloride |
| InChI | InChI=1S/C6H11N.ClH/c1-4-5-7-6(2)3;/h1,6-7H,5H2,2-3H3;1H |
| InChI Key | QKKKNXCLQBTMIB-UHFFFAOYSA-N |
| MDL Number | MFCD29046556 |
| Molecular Formula | C6H12ClN |
| Molecular Weight | 133.6192 |
| SMILES | Cl.CC(NCC#C)C |
| Synonyms | SCHEMBL7050146,
AKOS026746359,
N-isopropylprop-2-yn-1-amine hydrochloride,
(Prop-2-yn-1-yl)(propan-2-yl)amine hydrochloride,
F2147-2840,
215509-45-8,
|
| Complexity | 75.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 133.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 133.619g/mol |
| Monoisotopic Mass | 133.066g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number