ethene;thiophene

C18H20S4 — CID 175431475

IUPACethene;thiophene
SMILESC=C.c1ccsc1.c1ccsc1.c1ccsc1.c1ccsc1
InChIInChI=1S/4C4H4S.C2H4/c4*1-2-4-5-3-1;1-2/h4*1-4H;1-2H2
InChIKeyBPYSBFIZGREAHV-UHFFFAOYSA-N
MW364.63 g/mol
LogP7.79
Rot. Bonds

About ethene;thiophene

ethene;thiophene (PubChem CID 175431475) has the molecular formula C18H20S4 and a molecular weight of 364.63 g/mol. Its IUPAC name is ethene;thiophene.

Molecular Properties

Compound Nameethene;thiophene
PubChem CID175431475
Molecular FormulaC18H20S4
Molecular Weight364.63 g/mol
Exact Mass364.04
IUPAC Nameethene;thiophene
SMILESC=C.c1ccsc1.c1ccsc1.c1ccsc1.c1ccsc1
InChIInChI=1S/4C4H4S.C2H4/c4*1-2-4-5-3-1;1-2/h4*1-4H;1-2H2
InChIKeyBPYSBFIZGREAHV-UHFFFAOYSA-N
XLogP7.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.63
LogP ≤ 57.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethene;thiophene?
The IUPAC name of ethene;thiophene (CID 175431475) is ethene;thiophene.
What is the SMILES notation for ethene;thiophene?
The canonical SMILES for ethene;thiophene is C=C.c1ccsc1.c1ccsc1.c1ccsc1.c1ccsc1.
What is the InChIKey of ethene;thiophene?
The InChIKey is BPYSBFIZGREAHV-UHFFFAOYSA-N. The full InChI is InChI=1S/4C4H4S.C2H4/c4*1-2-4-5-3-1;1-2/h4*1-4H;1-2H2.
What are the key properties of ethene;thiophene?
ethene;thiophene has a molecular weight of 364.63 g/mol, XLogP of 7.79, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;thiophene is sourced from PubChem (CID 175431475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).