3,3,4-trimethyl-2-methylidene-octanoic acid

Systemtic Name: 3,3,4-trimethyl-2-methylidene-octanoic acid Openeye Name: 3,3,4-trimethyl-2-methylene-octanoic acid CAS Name: 3,3,4-trimethyl-2-methyleneoctanoic acid IUPAC Name: 3,3,4-trimethyl-2-methylideneoctanoic acid Traditional Name: 2-(1,1,2-trimethylhexyl)acrylic acid Formula: C12H22O2 MolecularWeight: 198.30188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(C)(C)C(=C)C(=O)O

Isomeric SMILES

CCCCC(C)C(C)(C)C(=C)C(=O)O

InChI

InChI=1S/C12H22O2/c1-6-7-8-9(2)12(4,5)10(3)11(13)14/h9H,3,6-8H2,1-2,4-5H3,(H,13,14)