2-(2-diphenylphosphorylethenyl)thiophene

C18H15OPS — CID 73098727

IUPAC2-(2-diphenylphosphorylethenyl)thiophene
SMILESO=P(C=Cc1cccs1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H15OPS/c19-20(16-8-3-1-4-9-16,17-10-5-2-6-11-17)14-13-18-12-7-15-21-18/h1-15H
InChIKeyDUTASOYCQATHFQ-UHFFFAOYSA-N
MW310.36 g/mol
LogP4.73
Rot. Bonds4

About 2-(2-diphenylphosphorylethenyl)thiophene

2-(2-diphenylphosphorylethenyl)thiophene (PubChem CID 73098727) has the molecular formula C18H15OPS and a molecular weight of 310.36 g/mol. Its IUPAC name is 2-(2-diphenylphosphorylethenyl)thiophene.

Molecular Properties

Compound Name2-(2-diphenylphosphorylethenyl)thiophene
PubChem CID73098727
Molecular FormulaC18H15OPS
Molecular Weight310.36 g/mol
Exact Mass310.06
IUPAC Name2-(2-diphenylphosphorylethenyl)thiophene
SMILESO=P(C=Cc1cccs1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H15OPS/c19-20(16-8-3-1-4-9-16,17-10-5-2-6-11-17)14-13-18-12-7-15-21-18/h1-15H
InChIKeyDUTASOYCQATHFQ-UHFFFAOYSA-N
XLogP4.73
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[[(1E,3E)-4-diphenylphosphorylbuta-1,3-dienyl]-phenylphosphoryl]benzene
CID 102152479
(E)-2-thiophen-2-ylethenol
CID 89297537
CID 11426392
CID 11426392
2,3,5,6-tetrakis[(E)-2-thiophen-2-ylethenyl]pyrazine
CID 19937826
(E)-3-thiophen-2-ylprop-2-enoic acid;hydrochloride
CID 88528301
5-(2-thiophen-2-ylethenyl)thiophene-2-carbaldehyde
CID 71357746
2-[(E)-2-dibutoxyphosphorylethenyl]thiophene
CID 5383939
2-[2-(2-thiophen-2-ylethenylsulfonyl)ethenyl]thiophene
CID 141485128
4-[(E)-2-thiophen-2-ylethenyl]pyridine
CID 10932177
[but-1-enyl(phenyl)phosphoryl]benzene
CID 177466990
2,4-dichloro-1-[(E)-2-diphenylphosphorylethenyl]benzene
CID 162401523
2-[(E)-2-(2-nitrophenyl)ethenyl]thiophene
CID 15723624

Frequently Asked Questions

What is the IUPAC name of 2-(2-diphenylphosphorylethenyl)thiophene?
The IUPAC name of 2-(2-diphenylphosphorylethenyl)thiophene (CID 73098727) is 2-(2-diphenylphosphorylethenyl)thiophene.
What is the SMILES notation for 2-(2-diphenylphosphorylethenyl)thiophene?
The canonical SMILES for 2-(2-diphenylphosphorylethenyl)thiophene is O=P(C=Cc1cccs1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(2-diphenylphosphorylethenyl)thiophene?
The InChIKey is DUTASOYCQATHFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15OPS/c19-20(16-8-3-1-4-9-16,17-10-5-2-6-11-17)14-13-18-12-7-15-21-18/h1-15H.
What are the key properties of 2-(2-diphenylphosphorylethenyl)thiophene?
2-(2-diphenylphosphorylethenyl)thiophene has a molecular weight of 310.36 g/mol, XLogP of 4.73, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-diphenylphosphorylethenyl)thiophene is sourced from PubChem (CID 73098727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).