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32113-46-5 | 4,4'-(Propane-2,2-diyl)bis(2-(sec-butyl)phenol)
CAS No: 32113-46-5 Catalog No: AG003F9U MDL No:
Product Description
Catalog Number:
AG003F9U
Chemical Name:
4,4'-(Propane-2,2-diyl)bis(2-(sec-butyl)phenol)
CAS Number:
32113-46-5
Molecular Formula:
C23H32O2
Molecular Weight:
340.4990
IUPAC Name:
2-butan-2-yl-4-[2-(3-butan-2-yl-4-hydroxyphenyl)propan-2-yl]phenol
InChI:
InChI=1S/C23H32O2/c1-7-15(3)19-13-17(9-11-21(19)24)23(5,6)18-10-12-22(25)20(14-18)16(4)8-2/h9-16,24-25H,7-8H2,1-6H3
InChI Key:
XCUMMFDPFFDQEX-UHFFFAOYSA-N
SMILES:
CCC(c1cc(ccc1O)C(c1ccc(c(c1)C(CC)C)O)(C)C)C
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.24g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
340.507g/mol
Monoisotopic Mass:
340.24g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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