ethenyl 7,7-dimethyloctanoate; ethenyl ethanoate; 2-ethylhexyl prop-2-enoate

Systemtic Name: ethenyl 7,7-dimethyloctanoate; ethenyl ethanoate; 2-ethylhexyl prop-2-enoate Openeye Name: 2-ethylhexyl prop-2-enoate; vinyl acetate; vinyl 7,7-dimethyloctanoate CAS Name: acetic acid ethenyl ester; 7,7-dimethyloctanoic acid ethenyl ester; 2-propenoic acid 2-ethylhexyl ester IUPAC Name: ethenyl acetate; ethenyl 7,7-dimethyloctanoate; 2-ethylhexyl prop-2-enoate Traditional Name: acetic acid vinyl ester; acrylic acid 2-ethylhexyl ester; 7,7-dimethylcaprylic acid vinyl ester Formula: C27H48O6 MolecularWeight: 468.66642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O2.C11H20O2.C4H6O2/c1-5-14-11(13)9-7-6-8-10-12(2,3)4;1-4-7-8-10(5-2)9-13-11(12)6-3;1-3-6-4(2)5/h5H,1,6-10H2,2-4H3;6,10H,3-5,7-9H2,1-2H3;3H,1H2,2H3