1-cyclohexylethenyl-ethoxy-oxophosphanium

C10H18O2P+ — CID 66796818

IUPAC1-cyclohexylethenyl-ethoxy-oxophosphanium
SMILESC=C(C1CCCCC1)[P+](=O)OCC
InChIInChI=1S/C10H18O2P/c1-3-12-13(11)9(2)10-7-5-4-6-8-10/h10H,2-8H2,1H3/q+1
InChIKeySOUUJNYOWCSDCT-UHFFFAOYSA-N
MW201.23 g/mol
LogP3.86
Rot. Bonds4

About 1-cyclohexylethenyl-ethoxy-oxophosphanium

1-cyclohexylethenyl-ethoxy-oxophosphanium (PubChem CID 66796818) has the molecular formula C10H18O2P+ and a molecular weight of 201.23 g/mol. Its IUPAC name is 1-cyclohexylethenyl-ethoxy-oxophosphanium.

Molecular Properties

Compound Name1-cyclohexylethenyl-ethoxy-oxophosphanium
PubChem CID66796818
Molecular FormulaC10H18O2P+
Molecular Weight201.23 g/mol
Exact Mass201.10
IUPAC Name1-cyclohexylethenyl-ethoxy-oxophosphanium
SMILESC=C(C1CCCCC1)[P+](=O)OCC
InChIInChI=1S/C10H18O2P/c1-3-12-13(11)9(2)10-7-5-4-6-8-10/h10H,2-8H2,1H3/q+1
InChIKeySOUUJNYOWCSDCT-UHFFFAOYSA-N
XLogP3.86
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexylethenyl-ethoxy-oxophosphanium?
The IUPAC name of 1-cyclohexylethenyl-ethoxy-oxophosphanium (CID 66796818) is 1-cyclohexylethenyl-ethoxy-oxophosphanium.
What is the SMILES notation for 1-cyclohexylethenyl-ethoxy-oxophosphanium?
The canonical SMILES for 1-cyclohexylethenyl-ethoxy-oxophosphanium is C=C(C1CCCCC1)[P+](=O)OCC.
What is the InChIKey of 1-cyclohexylethenyl-ethoxy-oxophosphanium?
The InChIKey is SOUUJNYOWCSDCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2P/c1-3-12-13(11)9(2)10-7-5-4-6-8-10/h10H,2-8H2,1H3/q+1.
What are the key properties of 1-cyclohexylethenyl-ethoxy-oxophosphanium?
1-cyclohexylethenyl-ethoxy-oxophosphanium has a molecular weight of 201.23 g/mol, XLogP of 3.86, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexylethenyl-ethoxy-oxophosphanium is sourced from PubChem (CID 66796818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).