2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene

C10H9S2- — CID 11985273

IUPAC2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene
SMILESC1=CC(SSc2cc[cH-]c2)C=C1
InChIInChI=1S/C10H9S2/c1-2-6-9(5-1)11-12-10-7-3-4-8-10/h1-9H/q-1
InChIKeySZQJCWAFEOCPLW-UHFFFAOYSA-N
MW193.32 g/mol
LogP3.64
Rot. Bonds3

About 2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene

2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene (PubChem CID 11985273) has the molecular formula C10H9S2- and a molecular weight of 193.32 g/mol. Its IUPAC name is 2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene.

Molecular Properties

Compound Name2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene
PubChem CID11985273
Molecular FormulaC10H9S2-
Molecular Weight193.32 g/mol
Exact Mass193.02
IUPAC Name2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene
SMILESC1=CC(SSc2cc[cH-]c2)C=C1
InChIInChI=1S/C10H9S2/c1-2-6-9(5-1)11-12-10-7-3-4-8-10/h1-9H/q-1
InChIKeySZQJCWAFEOCPLW-UHFFFAOYSA-N
XLogP3.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.32
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}

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Related Compounds

bis(chlorotitanium(1+));bis(2-cyclopenta-2,4-dien-1-ylcyclopenta-1,3-diene)
CID 50918959
7-(4-methylphenyl)sulfanylcyclohepta-1,3,5-triene
CID 86020256
lithium 2-methylcyclopenta-1,3-diene
CID 23687705
5-cyclopenta-2,4-dien-1-ylsulfanylsulfinylsulfanylcyclopenta-1,3-diene
CID 100937993
CID 159435544
CID 159435544
bis(3-cyclopenta-1,4-dien-1-ylpropyl(trimethyl)azanium);iron(2+);dichloride
CID 146680180
5H-inden-5-ide;zirconium(4+);trichloride
CID 74765452
[cyclopenta-2,4-dien-1-yl(phenyl)methyl]sulfanylbenzene
CID 12713629
1-cyclopenta-2,4-dien-1-ylcyclopenta-1,3-diene
CID 135031993
1-(3-cyclohexa-2,4-dien-1-ylpropyl)-3-methylpyrazole
CID 70949255
cyclopenta-1,4-dien-1-yl(diphenyl)phosphane;iron
CID 140759998
bis(2-butylcyclopenta-1,3-diene);carbanide;disilylidenezirconium;chloride
CID 161149505

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene?
The IUPAC name of 2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene (CID 11985273) is 2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene.
What is the SMILES notation for 2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene?
The canonical SMILES for 2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene is C1=CC(SSc2cc[cH-]c2)C=C1.
What is the InChIKey of 2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene?
The InChIKey is SZQJCWAFEOCPLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9S2/c1-2-6-9(5-1)11-12-10-7-3-4-8-10/h1-9H/q-1.
What are the key properties of 2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene?
2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene has a molecular weight of 193.32 g/mol, XLogP of 3.64, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopenta-2,4-dien-1-yldisulfanyl)cyclopenta-1,3-diene is sourced from PubChem (CID 11985273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).