CAS
111781-55-6 Purity
96%
111781-55-6 Purity
96%
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Specification
The molecular formula is C9H17N.
The molecular weight is 139.24 g/mol.
The IUPAC name is N-tert-butyl-2-methylbut-3-yn-2-amine.
The InChI is InChI=1S/C9H17N/c1-7-9(5,6)10-8(2,3)4/h1,10H,2-6H3.
The InChIKey is YXIAJHJGVGZXCG-UHFFFAOYSA-N.
The canonical SMILES is CC(C)(C)NC(C)(C)C#C.
The CAS number is 1118-17-8.
The European Community (EC) number is 624-045-6.
The XLogP3-AA value is 1.5.
Yes, N-tert-Butyl-1,1-dimethylpropargylamine is a canonicalized compound according to PubChem.