2,4-Bis[(dodecylthio)methyl]-6-methylphenol

C₃₃H₆₀OS₂CAS 110675-26-8536.96 g/mol

Open in Covalent MOL file

Phenol Sulfide

Properties

Molecular formula: C₃₃H₆₀OS₂
Molar mass: 536.96 g/mol
Exact mass: 536.4086 Da
logP: 12.01Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 26

Identifiers

CAS number

110675-26-8

SMILES

CCCCCCCCCCCCSCc1cc(C)c(O)c(CSCCCCCCCCCCCC)c1

InChIKey

VTFXHGBOGGGYDO-UHFFFAOYSA-N

InChI

InChI=1S/C33H60OS2/c1-4-6-8-10-12-14-16-18-20-22-24-35-28-31-26-30(3)33(34)32(27-31)29-36-25-23-21-19-17-15-13-11-9-7-5-2/h26-27,34H,4-25,28-29H2,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names

Phenol, 2,4-bis[(dodecylthio)methyl]-6-methyl-
Irganox 1726
2,4-Bis(dodecylthiomethyl)-6-methylphenol
4,6-Bis(dodecylthiomethyl)-o-cresol
2,4-Bis(n-dodecylthiomethyl)-6-methylphenol
Antioxidant 1726
HP 500
Antage HP 500
2,4-Bis(dodecylsulfanylmethyl)-6-methylphenol
2,4-Di(dodecylthiomethyl)-6-methylphenol
RC 1726

Work with 2,4-Bis[(dodecylthio)methyl]-6-methylphenol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Methyl-4,6-bis[(octylthio)methyl]phenol110553-27-0100 % similar Dodecyl sulfide2469-45-639 % similar Dioctyl sulfide2690-08-639 % similar 1-(Hexadecylthio)hexadecane3312-77-439 % similar Diheptyl sulfide629-65-239 % similar 1,1′-Thiobis[decane]693-83-439 % similar Pentyl sulfide872-10-636 % similar Tetradecylthioacetic acid2921-20-233 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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