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57100-74-0 | 4,4'-(Propane-2,2-diyl)bis(2-cyclohexylphenol)
CAS No: 57100-74-0 Catalog No: AG003F9S MDL No:
Product Description
Catalog Number:
AG003F9S
Chemical Name:
4,4'-(Propane-2,2-diyl)bis(2-cyclohexylphenol)
CAS Number:
57100-74-0
Molecular Formula:
C27H36O2
Molecular Weight:
392.5735
IUPAC Name:
2-cyclohexyl-4-[2-(3-cyclohexyl-4-hydroxyphenyl)propan-2-yl]phenol
InChI:
InChI=1S/C27H36O2/c1-27(2,21-13-15-25(28)23(17-21)19-9-5-3-6-10-19)22-14-16-26(29)24(18-22)20-11-7-4-8-12-20/h13-20,28-29H,3-12H2,1-2H3
InChI Key:
WKVWOPDUENJKAR-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1C1CCCCC1)C(c1ccc(c(c1)C1CCCCC1)O)(C)C
Properties
Complexity:
459
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:
9.1
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