2-[ethoxy(methyl)phosphoryl]thiophene

C7H11O2PS — CID 134935335

IUPAC2-[ethoxy(methyl)phosphoryl]thiophene
SMILESCCOP(C)(=O)c1cccs1
InChIInChI=1S/C7H11O2PS/c1-3-9-10(2,8)7-5-4-6-11-7/h4-6H,3H2,1-2H3
InChIKeyCFTVRTDSMXYLER-UHFFFAOYSA-N
MW190.20 g/mol
LogP2.32
Rot. Bonds3

About 2-[ethoxy(methyl)phosphoryl]thiophene

2-[ethoxy(methyl)phosphoryl]thiophene (PubChem CID 134935335) has the molecular formula C7H11O2PS and a molecular weight of 190.20 g/mol. Its IUPAC name is 2-[ethoxy(methyl)phosphoryl]thiophene.

Molecular Properties

Compound Name2-[ethoxy(methyl)phosphoryl]thiophene
PubChem CID134935335
Molecular FormulaC7H11O2PS
Molecular Weight190.20 g/mol
Exact Mass190.02
IUPAC Name2-[ethoxy(methyl)phosphoryl]thiophene
SMILESCCOP(C)(=O)c1cccs1
InChIInChI=1S/C7H11O2PS/c1-3-9-10(2,8)7-5-4-6-11-7/h4-6H,3H2,1-2H3
InChIKeyCFTVRTDSMXYLER-UHFFFAOYSA-N
XLogP2.32
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[ethoxy(methyl)phosphoryl]thiophene?
The IUPAC name of 2-[ethoxy(methyl)phosphoryl]thiophene (CID 134935335) is 2-[ethoxy(methyl)phosphoryl]thiophene.
What is the SMILES notation for 2-[ethoxy(methyl)phosphoryl]thiophene?
The canonical SMILES for 2-[ethoxy(methyl)phosphoryl]thiophene is CCOP(C)(=O)c1cccs1.
What is the InChIKey of 2-[ethoxy(methyl)phosphoryl]thiophene?
The InChIKey is CFTVRTDSMXYLER-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11O2PS/c1-3-9-10(2,8)7-5-4-6-11-7/h4-6H,3H2,1-2H3.
What are the key properties of 2-[ethoxy(methyl)phosphoryl]thiophene?
2-[ethoxy(methyl)phosphoryl]thiophene has a molecular weight of 190.20 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethoxy(methyl)phosphoryl]thiophene is sourced from PubChem (CID 134935335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).