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3294-03-9 | 2,2-Thiodi(4-tert-octylphenol)
CAS No: 3294-03-9 Catalog No: AG003FCP MDL No:MFCD00190577
Product Description
Catalog Number:
AG003FCP
Chemical Name:
2,2-Thiodi(4-tert-octylphenol)
CAS Number:
3294-03-9
MDL Number:
MFCD00190577
IUPAC Name:
2-[2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]sulfanyl-4-(2,4,4-trimethylpentan-2-yl)phenol
InChI:
InChI=1S/C28H42O2S/c1-25(2,3)17-27(7,8)19-11-13-21(29)23(15-19)31-24-16-20(12-14-22(24)30)28(9,10)18-26(4,5)6/h11-16,29-30H,17-18H2,1-10H3
InChI Key:
WQYFETFRIRDUPJ-UHFFFAOYSA-N
EC Number:
221-959-3
Properties
Complexity:
519
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
442.291g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
442.702g/mol
Monoisotopic Mass:
442.291g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.1
Literature
| Title | Journal |
|---|---|
| Synthesis, structural studies and reactivity of vanadium complexes with tridentate (OSO) ligand. | Dalton transactions (Cambridge, England : 2003) 20070528 |
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