2-(ethenylsulfanylmethyl)thiophene

C7H8S2 — CID 19076101

IUPAC2-(ethenylsulfanylmethyl)thiophene
SMILESC=CSCc1cccs1
InChIInChI=1S/C7H8S2/c1-2-8-6-7-4-3-5-9-7/h2-5H,1,6H2
InChIKeyMROYMNGBZPBJGD-UHFFFAOYSA-N
MW156.27 g/mol
LogP3.12
Rot. Bonds3

About 2-(ethenylsulfanylmethyl)thiophene

2-(ethenylsulfanylmethyl)thiophene (PubChem CID 19076101) has the molecular formula C7H8S2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-(ethenylsulfanylmethyl)thiophene.

Molecular Properties

Compound Name2-(ethenylsulfanylmethyl)thiophene
PubChem CID19076101
Molecular FormulaC7H8S2
Molecular Weight156.27 g/mol
Exact Mass156.01
IUPAC Name2-(ethenylsulfanylmethyl)thiophene
SMILESC=CSCc1cccs1
InChIInChI=1S/C7H8S2/c1-2-8-6-7-4-3-5-9-7/h2-5H,1,6H2
InChIKeyMROYMNGBZPBJGD-UHFFFAOYSA-N
XLogP3.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(ethenylsulfanylmethyl)thiophene?
The IUPAC name of 2-(ethenylsulfanylmethyl)thiophene (CID 19076101) is 2-(ethenylsulfanylmethyl)thiophene.
What is the SMILES notation for 2-(ethenylsulfanylmethyl)thiophene?
The canonical SMILES for 2-(ethenylsulfanylmethyl)thiophene is C=CSCc1cccs1.
What is the InChIKey of 2-(ethenylsulfanylmethyl)thiophene?
The InChIKey is MROYMNGBZPBJGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8S2/c1-2-8-6-7-4-3-5-9-7/h2-5H,1,6H2.
What are the key properties of 2-(ethenylsulfanylmethyl)thiophene?
2-(ethenylsulfanylmethyl)thiophene has a molecular weight of 156.27 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethenylsulfanylmethyl)thiophene is sourced from PubChem (CID 19076101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).