6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol

C10H14OS2 — CID 10465846

IUPAC6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol
SMILESC=CC1=CC(O)CCC12SCCS2
InChIInChI=1S/C10H14OS2/c1-2-8-7-9(11)3-4-10(8)12-5-6-13-10/h2,7,9,11H,1,3-6H2
InChIKeyRWBRDXLHVOCYFT-UHFFFAOYSA-N
MW214.35 g/mol
LogP2.43
Rot. Bonds1

About 6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol

6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol (PubChem CID 10465846) has the molecular formula C10H14OS2 and a molecular weight of 214.35 g/mol. Its IUPAC name is 6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol.

Molecular Properties

Compound Name6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol
PubChem CID10465846
Molecular FormulaC10H14OS2
Molecular Weight214.35 g/mol
Exact Mass214.05
IUPAC Name6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol
SMILESC=CC1=CC(O)CCC12SCCS2
InChIInChI=1S/C10H14OS2/c1-2-8-7-9(11)3-4-10(8)12-5-6-13-10/h2,7,9,11H,1,3-6H2
InChIKeyRWBRDXLHVOCYFT-UHFFFAOYSA-N
XLogP2.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol with MolForge

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Related Compounds

11-Ethenyl-1,5-dithiaspiro[5.5]undec-10-en-9-ol
CID 10398906
1,6,7,11-Tetrahydrobenzo[d][1]benzothiepin-11-ol
CID 20232264
1-(4-Methyl-1,3-dithiolan-2-yl)dec-2-en-4-ol
CID 88789774
1-Cyclohexa-1,3-dien-1-yl-2-(trimethyl-lambda4-sulfanyl)ethanol
CID 123682573
3,4,5,6-tetrahydro-1H-isothiochromen-4-ol
CID 140994155
2,3,4,5-Tetrahydro-1-benzothiophen-4-ol
CID 145675117
(8E)-8-prop-2-enylidene-3,4,5,7,9,10-hexahydro-2H-1,6-benzodithiocin-7-ol
CID 174278039
(9S)-11-ethenyl-1,5-dithiaspiro[5.5]undec-10-en-9-ol
CID 10537345
(9R)-11-ethenyl-1,5-dithiaspiro[5.5]undec-10-en-9-ol
CID 10846985
(1S,2R)-3-(1,3-dithiolan-2-yl)cyclohexa-3,5-diene-1,2-diol
CID 10954978
4-(1,3-Dithiolan-2-yl)cyclohexa-2,4-dien-1-ol
CID 11229419
(7R)-9-(hydroxymethyl)-1,4-dithiaspiro[4.4]non-8-en-7-ol
CID 71413843

Frequently Asked Questions

What is the IUPAC name of 6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol?
The IUPAC name of 6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol (CID 10465846) is 6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol.
What is the SMILES notation for 6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol?
The canonical SMILES for 6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol is C=CC1=CC(O)CCC12SCCS2.
What is the InChIKey of 6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol?
The InChIKey is RWBRDXLHVOCYFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14OS2/c1-2-8-7-9(11)3-4-10(8)12-5-6-13-10/h2,7,9,11H,1,3-6H2.
What are the key properties of 6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol?
6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol has a molecular weight of 214.35 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-1,4-dithiaspiro[4.5]dec-6-en-8-ol is sourced from PubChem (CID 10465846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).