tert-butylcyclohexane; (2-tert-butylcyclohexyl) ethanoate

Systemtic Name: tert-butylcyclohexane; (2-tert-butylcyclohexyl) ethanoate Openeye Name: tert-butylcyclohexane; (2-tert-butylcyclohexyl) acetate CAS Name: acetic acid (2-tert-butylcyclohexyl) ester; tert-butylcyclohexane IUPAC Name: tert-butylcyclohexane; (2-tert-butylcyclohexyl) acetate Traditional Name: acetic acid (2-tert-butylcyclohexyl) ester; tert-butylcyclohexane Formula: C74H144O4 MolecularWeight: 1097.93276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCCCC1C(C)(C)C.CC(=O)OC1CCCCC1C(C)(C)C.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1

Isomeric SMILES

CC(=O)OC1CCCCC1C(C)(C)C.CC(=O)OC1CCCCC1C(C)(C)C.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1.CC(C)(C)C1CCCCC1

InChI

InChI=1S/2C12H22O2.5C10H20/c2*1-9(13)14-11-8-6-5-7-10(11)12(2,3)4;5*1-10(2,3)9-7-5-4-6-8-9/h2*10-11H,5-8H2,1-4H3;5*9H,4-8H2,1-3H3