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Tiadenol

HCID 23403
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
6964-20-1
Standard SMILES
OCCSCCCCCCCCCCSCCO
InChIKey
WRCITXQNXAIKLR-UHFFFAOYSA-N
Molecular formula
C14H30O2S2
Average molar mass
294.5 g/mol
Monoisotopic mass
294.16872254

Overview

Tiadenol is an aliphatic sulfide.

Names & identifiers

Preferred name
Tiadenol
IUPAC
2-[10-(2-hydroxyethylsulfanyl)decylsulfanyl]ethanol
English name
2,2'-(decamethylenedithio)diethanol
Molecular formula
C14H30O2S2
Molecular weight
294.52

Names & synonyms

TIADENOLThiadenolFonlipol6964-20-1EulipfinlipoltiaterolLL 1558Tiadenolum1,10-Bis(hydroxyethylthio)decane1,10-Bis(2-hydroxyethylthio)decane2,2'-(Decamethylenedithio)diethanol
Show more names
FonilapNsc66316LL1558 NSC 66316Ethanol, 2,2'-[1,10-decanediylbis(thio)]bis-
Ethanol, 2,2'-(decamethylenedithio)di-NSC-663162,2'-(1,10-Decanediylbis(thio))bis-ethanol2,2'-(decamethylenedithio)-diethanolEthanol, 2,2'-(1,10-decanediylbis(thio))bis-LL-155822251270CXDTXSID50219903

Database identifiers

CAS
6964-20-1
PubChem CID
23403
DTXSID
DTXSID50219903
ChEMBL
CHEMBL1697775
ChEBI
CHEBI:135235
UNII
22251270CX
EC Number
230-165-6
Nikkaji
J803.263G

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
91.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
15
Heavy atoms
18
Formal charge
0
Complexity
130

Experimental & physicochemical properties

DrugsPharmaceuticals -> Antilipidemics

Physicochemical properties

Melting point
69.5 ° · 69.5°
Boiling point
458.1 · 458.1±20.0 °C(Predicted)
Density
1.042 · 1.042±0.06 g/cm3(Predicted)
pka
14.21 · 14.21±0.10(Predicted)
EWG's Food Scores
1 · 1
FDA UNII
22251270 CX · 22251270CX
Toxicity
10 gm/kg · LDLo oral in mouse: 10gm/kg

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory InformationChemical: Ethanol, 2,2'-[1,10-decanediylbis(thio)]bis-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Safety data

Toxicity
LDLo oral in mouse: 10gm/kg

Chemistry & industry

Pharmacology

ATC Code · 2 items

C - Cardiovascular system

QC - Cardiovascular system

MeSH Pharmacological ClassificationSubstances that lower the levels of certain LIPIDS in the BLOOD. They are used to treat HYPERLIPIDEMIAS.

Upstream & downstream products

Upstream raw materials

2-Mercaptoethanol1,10-Dibromodecane

Suppliers5 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
LGM Pharma1-(800)-881-8210 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]

Additional notes

DefinitionChEBI: Tiadenol is an aliphatic sulfide.

Related reactions

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Compound notes

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