4-ethylhexane-1,4-diol; N-methylpropan-2-amine

Systemtic Name: 4-ethylhexane-1,4-diol; N-methylpropan-2-amine Openeye Name: 4-ethylhexane-1,4-diol; N-methylpropan-2-amine CAS Name: 4-ethylhexane-1,4-diol; N-methyl-2-propanamine IUPAC Name: 4-ethylhexane-1,4-diol; N-methylpropan-2-amine Traditional Name: 4-ethylhexane-1,4-diol; isopropyl(methyl)amine Formula: C12H29NO2 MolecularWeight: 219.36416

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCCO)O.CC(C)NC

Isomeric SMILES

CCC(CC)(CCCO)O.CC(C)NC

InChI

InChI=1S/C8H18O2.C4H11N/c1-3-8(10,4-2)6-5-7-9;1-4(2)5-3/h9-10H,3-7H2,1-2H3;4-5H,1-3H3