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2-ethylhexyl prop-2-enoate; 2-methylidenebutanedioic acid

2-ethylhexyl prop-2-enoate; 2-methylidenebutanedioic acid

Systemtic Name:2-ethylhexyl prop-2-enoate; 2-methylidenebutanedioic acid
Openeye Name:2-ethylhexyl prop-2-enoate; 2-methylenebutanedioic acid
CAS Name:2-methylenebutanedioic acid; 2-propenoic acid 2-ethylhexyl ester
IUPAC Name:2-ethylhexyl prop-2-enoate; 2-methylidenebutanedioic acid
Traditional Name:acrylic acid 2-ethylhexyl ester; itaconic acid
Formula: C16H26O6
MolecularWeight: 314.37404
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C11H20O2.C5H6O4/c1-4-7-8-10(5-2)9-13-11(12)6-3;1-3(5(8)9)2-4(6)7/h6,10H,3-5,7-9H2,1-2H3;1-2H2,(H,6,7)(H,8,9)


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