CAS
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Specification
The molecular formula is C7H18ClN.
The molecular weight is 151.68 g/mol.
The IUPAC name is 2-methyl-N-propan-2-ylpropan-1-amine hydrochloride.
The InChI is InChI=1S/C7H17N.ClH/c1-6(2)5-8-7(3)4;/h6-8H,5H2,1-4H3;1H.
The InChIKey is MQBUMZZSHWKKJZ-UHFFFAOYSA-N.
The Canonical SMILES is CC(C)CNC(C)C.Cl.
The hydrogen bond donor count is 2.
The hydrogen bond acceptor count is 1.
There are 3 rotatable bonds.
The topological polar surface area is 12Ų.