2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene

C12H12S2 — CID 134862779

IUPAC2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene
SMILESCC(/C=C/c1cccs1)c1cccs1
InChIInChI=1S/C12H12S2/c1-10(12-5-3-9-14-12)6-7-11-4-2-8-13-11/h2-10H,1H3/b7-6+
InChIKeyDLTYZPXWMHGQLZ-VOTSOKGWSA-N
MW220.36 g/mol
LogP4.63
Rot. Bonds3

About 2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene

2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene (PubChem CID 134862779) has the molecular formula C12H12S2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene.

Molecular Properties

Compound Name2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene
PubChem CID134862779
Molecular FormulaC12H12S2
Molecular Weight220.36 g/mol
Exact Mass220.04
IUPAC Name2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene
SMILESCC(/C=C/c1cccs1)c1cccs1
InChIInChI=1S/C12H12S2/c1-10(12-5-3-9-14-12)6-7-11-4-2-8-13-11/h2-10H,1H3/b7-6+
InChIKeyDLTYZPXWMHGQLZ-VOTSOKGWSA-N
XLogP4.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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1,3,5-tris(1-thiophen-2-ylethyl)-1,3,5-triazinane
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CID 131873611
2-methyl-5-[(E)-2-thiophen-2-ylethenyl]thiophene
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CID 11426392
2,3,5,6-tetrakis[(E)-2-thiophen-2-ylethenyl]pyrazine
CID 19937826
2-[(1E,3E)-4-thiophen-2-ylbuta-1,3-dienyl]-5-[(1E,3E)-4-[5-[(1E,3E)-4-thiophen-2-ylbuta-1,3-dienyl]thiophen-2-yl]buta-1,3-dienyl]thiophene
CID 10885407
2-[(1Z,4Z)-hepta-1,4-dienyl]thiophene
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[(E)-3-thiophen-2-ylprop-2-enoyl] (E)-3-thiophen-2-ylprop-2-enoate
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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene?
The IUPAC name of 2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene (CID 134862779) is 2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene.
What is the SMILES notation for 2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene?
The canonical SMILES for 2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene is CC(/C=C/c1cccs1)c1cccs1.
What is the InChIKey of 2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene?
The InChIKey is DLTYZPXWMHGQLZ-VOTSOKGWSA-N. The full InChI is InChI=1S/C12H12S2/c1-10(12-5-3-9-14-12)6-7-11-4-2-8-13-11/h2-10H,1H3/b7-6+.
What are the key properties of 2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene?
2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene has a molecular weight of 220.36 g/mol, XLogP of 4.63, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-3-thiophen-2-ylbut-1-enyl]thiophene is sourced from PubChem (CID 134862779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).