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4066-02-8 | 6,6'-Methylenebis(2-cyclohexyl-4-methylphenol)
CAS No: 4066-02-8 Catalog No: AG003FCE MDL No:MFCD10000968
Product Description
Catalog Number:
AG003FCE
Chemical Name:
6,6'-Methylenebis(2-cyclohexyl-4-methylphenol)
CAS Number:
4066-02-8
Molecular Formula:
C27H36O2
Molecular Weight:
392.5735
MDL Number:
MFCD10000968
IUPAC Name:
2-cyclohexyl-6-[(3-cyclohexyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenol
InChI:
InChI=1S/C27H36O2/c1-18-13-22(26(28)24(15-18)20-9-5-3-6-10-20)17-23-14-19(2)16-25(27(23)29)21-11-7-4-8-12-21/h13-16,20-21,28-29H,3-12,17H2,1-2H3
InChI Key:
AKNMPWVTPUHKCG-UHFFFAOYSA-N
SMILES:
Cc1cc(Cc2cc(C)cc(c2O)C2CCCCC2)c(c(c1)C1CCCCC1)O
EC Number:
223-773-8
UNII:
6825HV3123
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.272g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
392.583g/mol
Monoisotopic Mass:
392.272g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.9
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