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139645-78-6 | Phenol, 2,6-bis(1,1-dimethylethyl)-4-[[(dodecyldimethylsilyl)methyl]thio]-
CAS No: 139645-78-6 Catalog No: AG001BFH MDL No:
Product Description
Catalog Number:
AG001BFH
Chemical Name:
Phenol, 2,6-bis(1,1-dimethylethyl)-4-[[(dodecyldimethylsilyl)methyl]thio]-
CAS Number:
139645-78-6
Molecular Formula:
C29H54OSSi
Molecular Weight:
478.8890
IUPAC Name:
2,6-ditert-butyl-4-[[dodecyl(dimethyl)silyl]methylsulfanyl]phenol
InChI:
InChI=1S/C29H54OSSi/c1-10-11-12-13-14-15-16-17-18-19-20-32(8,9)23-31-24-21-25(28(2,3)4)27(30)26(22-24)29(5,6)7/h21-22,30H,10-20,23H2,1-9H3
InChI Key:
HAJCSVOESVOLSN-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC[Si](CSc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)(C)C
Properties
Complexity:
466
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
478.366g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
478.895g/mol
Monoisotopic Mass:
478.366g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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