[ethoxy(ethyl)phosphoryl]oxymethylcyclopropane

C8H17O3P — CID 87083673

IUPAC[ethoxy(ethyl)phosphoryl]oxymethylcyclopropane
SMILESCCOP(=O)(CC)OCC1CC1
InChIInChI=1S/C8H17O3P/c1-3-10-12(9,4-2)11-7-8-5-6-8/h8H,3-7H2,1-2H3
InChIKeyHKVCYXPPTIRQSJ-UHFFFAOYSA-N
MW192.19 g/mol
LogP2.66
Rot. Bonds6

About [ethoxy(ethyl)phosphoryl]oxymethylcyclopropane

[ethoxy(ethyl)phosphoryl]oxymethylcyclopropane (PubChem CID 87083673) has the molecular formula C8H17O3P and a molecular weight of 192.19 g/mol. Its IUPAC name is [ethoxy(ethyl)phosphoryl]oxymethylcyclopropane.

Molecular Properties

Compound Name[ethoxy(ethyl)phosphoryl]oxymethylcyclopropane
PubChem CID87083673
Molecular FormulaC8H17O3P
Molecular Weight192.19 g/mol
Exact Mass192.09
IUPAC Name[ethoxy(ethyl)phosphoryl]oxymethylcyclopropane
SMILESCCOP(=O)(CC)OCC1CC1
InChIInChI=1S/C8H17O3P/c1-3-10-12(9,4-2)11-7-8-5-6-8/h8H,3-7H2,1-2H3
InChIKeyHKVCYXPPTIRQSJ-UHFFFAOYSA-N
XLogP2.66
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 52.66
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 [ethoxy(ethyl)phosphoryl]oxymethylcyclopropane?
The IUPAC name of [ethoxy(ethyl)phosphoryl]oxymethylcyclopropane (CID 87083673) is [ethoxy(ethyl)phosphoryl]oxymethylcyclopropane.
What is the SMILES notation for [ethoxy(ethyl)phosphoryl]oxymethylcyclopropane?
The canonical SMILES for [ethoxy(ethyl)phosphoryl]oxymethylcyclopropane is CCOP(=O)(CC)OCC1CC1.
What is the InChIKey of [ethoxy(ethyl)phosphoryl]oxymethylcyclopropane?
The InChIKey is HKVCYXPPTIRQSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17O3P/c1-3-10-12(9,4-2)11-7-8-5-6-8/h8H,3-7H2,1-2H3.
What are the key properties of [ethoxy(ethyl)phosphoryl]oxymethylcyclopropane?
[ethoxy(ethyl)phosphoryl]oxymethylcyclopropane has a molecular weight of 192.19 g/mol, XLogP of 2.66, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [ethoxy(ethyl)phosphoryl]oxymethylcyclopropane is sourced from PubChem (CID 87083673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).