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1620-93-5 | Phenol, 4,4'-[thiobis(methylene)]bis[2,6-bis(1,1-dimethylethyl)-
CAS No: 1620-93-5 Catalog No: AG001SLS MDL No:
Product Description
Catalog Number:
AG001SLS
Chemical Name:
Phenol, 4,4'-[thiobis(methylene)]bis[2,6-bis(1,1-dimethylethyl)-
CAS Number:
1620-93-5
Molecular Formula:
C30H46O2S
Molecular Weight:
470.7500
IUPAC Name:
2,6-ditert-butyl-4-[(3,5-ditert-butyl-4-hydroxyphenyl)methylsulfanylmethyl]phenol
InChI:
InChI=1S/C30H46O2S/c1-27(2,3)21-13-19(14-22(25(21)31)28(4,5)6)17-33-18-20-15-23(29(7,8)9)26(32)24(16-20)30(10,11)12/h13-16,31-32H,17-18H2,1-12H3
InChI Key:
UDFARPRXWMDFQU-UHFFFAOYSA-N
SMILES:
CC(c1cc(CSCc2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)cc(c1O)C(C)(C)C)(C)C
EC Number:
216-591-5
Properties
Complexity:
513
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
470.322g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
470.756g/mol
Monoisotopic Mass:
470.322g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.8
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