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The molecular formula of allyl 2-methylisocrotonate is C8H12O2.
The synonym for allyl 2-methylisocrotonate is PROP-2-EN-1-YL (2Z)-2-METHYLBUT-2-ENOATE.
The molecular weight of allyl 2-methylisocrotonate is 140.18 g/mol.
The IUPAC name of allyl 2-methylisocrotonate is prop-2-enyl (Z)-2-methylbut-2-enoate.
The InChI of allyl 2-methylisocrotonate is InChI=1S/C8H12O2/c1-4-6-10-8(9)7(3)5-2/h4-5H,1,6H2,2-3H3/b7-5-.
The InChIKey of allyl 2-methylisocrotonate is ODOZNBUSHKFCSH-ALCCZGGFSA-N.
The canonical SMILES of allyl 2-methylisocrotonate is CC=C(C)C(=O)OCC=C.
The CAS number of allyl 2-methylisocrotonate is 97158-39-9.
The XLogP3-AA value of allyl 2-methylisocrotonate is 2.
Yes, allyl 2-methylisocrotonate is a canonicalized compound.
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