2-ethylhexyl prop-2-enoate; 6-methylheptyl prop-2-enoate; prop-2-enoic acid

Systemtic Name: 2-ethylhexyl prop-2-enoate; 6-methylheptyl prop-2-enoate; prop-2-enoic acid Openeye Name: acrylic acid; 2-ethylhexyl prop-2-enoate; 6-methylheptyl prop-2-enoate CAS Name: 2-propenoic acid; 2-propenoic acid 2-ethylhexyl ester; 2-propenoic acid 6-methylheptyl ester IUPAC Name: 2-ethylhexyl prop-2-enoate; 6-methylheptyl prop-2-enoate; prop-2-enoic acid Traditional Name: acrylic acid; acrylic acid 2-ethylhexyl ester; acrylic acid 6-methylheptyl ester Formula: C25H44O6 MolecularWeight: 440.61326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C=C.CC(C)CCCCCOC(=O)C=C.C=CC(=O)O

Isomeric SMILES

CCCCC(CC)COC(=O)C=C.CC(C)CCCCCOC(=O)C=C.C=CC(=O)O

InChI

InChI=1S/2C11H20O2.C3H4O2/c1-4-11(12)13-9-7-5-6-8-10(2)3;1-4-7-8-10(5-2)9-13-11(12)6-3;1-2-3(4)5/h4,10H,1,5-9H2,2-3H3;6,10H,3-5,7-9H2,1-2H3;2H,1H2,(H,4,5)