4,4'-Methylenebis(2-cyclohexyl-5-methylphenol) - bicyclo[2.2.0]hexa-1(6),2,4-trien-2-ol (1:1)

ChemSpider ID: 16132550
Molecular Formula: C₃₃H₄₀O₃
Average mass: 484.668915 Da
Monoisotopic mass: 484.29776 Da
Systematic name

4,4'-Methylenebis(2-cyclohexyl-5-methylphenol) - bicyclo[2.2.0]hexa-1(6),2,4-trien-2-ol (1:1)
SMILES and InChIs

SMILES:

O\C\2=C\C1=C\C=C1/2.Oc2cc(C)c(cc2C1CCCCC1)Cc3cc(c(O)cc3C)C4CCCCC4 Copied

Std. InChI:

InChI=1S/C27H36O2.C6H4O/c1-18-13-26(28)24(20-9-5-3-6-10-20)16-22(18)15-23-17-25(27(29)14-19(23)2)21-11-7-4-8-12-21;7-6-3-4-1-2-5(4)6/h13-14,16-17,20-21,28-29H,3-12,15H2,1-2H3;1-3,7H Copied

Std. InChIKey:

DQNJCIXTQDKTEA-UHFFFAOYSA-N Copied
Cite this record
CSID:16132550, http://www.chemspider.com/Chemical-Structure.16132550.html (accessed 15:33, May 24, 2012) Copied

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Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.