ethoxy-(1-hydroxycyclohexyl)-oxophosphanium

C8H16O3P+ — CID 11275535

IUPACethoxy-(1-hydroxycyclohexyl)-oxophosphanium
SMILESCCO[P+](=O)C1(O)CCCCC1
InChIInChI=1S/C8H16O3P/c1-2-11-12(10)8(9)6-4-3-5-7-8/h9H,2-7H2,1H3/q+1
InChIKeyXFOGLXLXVIJHJU-UHFFFAOYSA-N
MW191.19 g/mol
LogP2.42
Rot. Bonds3

About ethoxy-(1-hydroxycyclohexyl)-oxophosphanium

ethoxy-(1-hydroxycyclohexyl)-oxophosphanium (PubChem CID 11275535) has the molecular formula C8H16O3P+ and a molecular weight of 191.19 g/mol. Its IUPAC name is ethoxy-(1-hydroxycyclohexyl)-oxophosphanium.

Molecular Properties

Compound Nameethoxy-(1-hydroxycyclohexyl)-oxophosphanium
PubChem CID11275535
Molecular FormulaC8H16O3P+
Molecular Weight191.19 g/mol
Exact Mass191.08
IUPAC Nameethoxy-(1-hydroxycyclohexyl)-oxophosphanium
SMILESCCO[P+](=O)C1(O)CCCCC1
InChIInChI=1S/C8H16O3P/c1-2-11-12(10)8(9)6-4-3-5-7-8/h9H,2-7H2,1H3/q+1
InChIKeyXFOGLXLXVIJHJU-UHFFFAOYSA-N
XLogP2.42
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze ethoxy-(1-hydroxycyclohexyl)-oxophosphanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 150950
CID 150950
CID 574009
CID 574009
CID 660263
CID 660263
CID 11831412
CID 11831412
CID 519354
CID 519354
CID 15397227
CID 15397227
CID 87127831
CID 87127831
CID 73096836
CID 73096836
CID 6453953
CID 6453953
CID 14877041
CID 14877041
CID 86016162
CID 86016162
CID 86086183
CID 86086183

Frequently Asked Questions

What is the IUPAC name of ethoxy-(1-hydroxycyclohexyl)-oxophosphanium?
The IUPAC name of ethoxy-(1-hydroxycyclohexyl)-oxophosphanium (CID 11275535) is ethoxy-(1-hydroxycyclohexyl)-oxophosphanium.
What is the SMILES notation for ethoxy-(1-hydroxycyclohexyl)-oxophosphanium?
The canonical SMILES for ethoxy-(1-hydroxycyclohexyl)-oxophosphanium is CCO[P+](=O)C1(O)CCCCC1.
What is the InChIKey of ethoxy-(1-hydroxycyclohexyl)-oxophosphanium?
The InChIKey is XFOGLXLXVIJHJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O3P/c1-2-11-12(10)8(9)6-4-3-5-7-8/h9H,2-7H2,1H3/q+1.
What are the key properties of ethoxy-(1-hydroxycyclohexyl)-oxophosphanium?
ethoxy-(1-hydroxycyclohexyl)-oxophosphanium has a molecular weight of 191.19 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-(1-hydroxycyclohexyl)-oxophosphanium is sourced from PubChem (CID 11275535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).