92368-02-0 Purity
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The molecular formula of Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylate is C14H22O2.
The molecular weight of Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylate is 222.32 g/mol.
The IUPAC name of Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylate is ethyl (E)-3-(2,6,6-trimethylcyclohexen-1-yl)prop-2-enoate.
The InChI of Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylate is InChI=1S/C14H22O2/c1-5-16-13(15)9-8-12-11(2)7-6-10-14(12,3)4/h8-9H,5-7,10H2,1-4H3/b9-8+.
The InChIKey of Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylate is SGHXYRRAFDSHBV-CMDGGOBGSA-N.
The canonical SMILES of Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylate is CCOC(=O)C=CC1=C(CCCC1(C)C)C.
The CAS number of Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylate is 92369-26-1.
The EC number of Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylate is 296-230-6.
The XLogP3-AA value of Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylate is 3.4.
Yes, Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylate is a canonicalized compound.