2-(thiiran-2-yl)thiirane

C4H6S2 — CID 22946685

IUPAC2-(thiiran-2-yl)thiirane
SMILESC1SC1C1CS1
InChIInChI=1S/C4H6S2/c1-3(5-1)4-2-6-4/h3-4H,1-2H2
InChIKeySUJKJZIKQSNVTC-UHFFFAOYSA-N
MW118.23 g/mol
LogP1.22
Rot. Bonds1

About 2-(thiiran-2-yl)thiirane

2-(thiiran-2-yl)thiirane (PubChem CID 22946685) has the molecular formula C4H6S2 and a molecular weight of 118.23 g/mol. Its IUPAC name is 2-(thiiran-2-yl)thiirane.

Molecular Properties

Compound Name2-(thiiran-2-yl)thiirane
PubChem CID22946685
Molecular FormulaC4H6S2
Molecular Weight118.23 g/mol
Exact Mass117.99
IUPAC Name2-(thiiran-2-yl)thiirane
SMILESC1SC1C1CS1
InChIInChI=1S/C4H6S2/c1-3(5-1)4-2-6-4/h3-4H,1-2H2
InChIKeySUJKJZIKQSNVTC-UHFFFAOYSA-N
XLogP1.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.23
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

2,2'-(Disulfanediylbis(methylene))bis(thiirane)
CID 57402
1,1'-Thiobis(2,3-epithiopropane)
CID 10976066
2-Methylthiirane;thiirane
CID 22367971
2-(Thiiran-2-ylmethylsulfanylmethylsulfanylmethyl)thiirane
CID 21900599
2-(Thiiran-2-ylmethyl)thiirane
CID 21987805
2-[[(Thiiran-2-ylmethyldisulfanyl)methyldisulfanyl]methyl]thiirane
CID 22388735
CID 59269553
CID 59269553
Bis(thiiran-2-ylmethyl)tin
CID 59341510
2-[(Thiiran-2-ylmethyltrisulfanyl)methyl]thiirane
CID 87221702
2-[(Thiiran-2-ylmethyltetrasulfanyl)methyl]thiirane
CID 87221918
2-[2-(Thiiran-2-yl)ethyl]thiirane
CID 87691933
1,4-Dithiaspiro[2.2]pentane
CID 87692098

Frequently Asked Questions

What is the IUPAC name of 2-(thiiran-2-yl)thiirane?
The IUPAC name of 2-(thiiran-2-yl)thiirane (CID 22946685) is 2-(thiiran-2-yl)thiirane.
What is the SMILES notation for 2-(thiiran-2-yl)thiirane?
The canonical SMILES for 2-(thiiran-2-yl)thiirane is C1SC1C1CS1.
What is the InChIKey of 2-(thiiran-2-yl)thiirane?
The InChIKey is SUJKJZIKQSNVTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6S2/c1-3(5-1)4-2-6-4/h3-4H,1-2H2.
What are the key properties of 2-(thiiran-2-yl)thiirane?
2-(thiiran-2-yl)thiirane has a molecular weight of 118.23 g/mol, XLogP of 1.22, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiiran-2-yl)thiirane is sourced from PubChem (CID 22946685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).