cyclohexyl(diethoxyphosphoryl)methanol

C11H23O4P — CID 15253198

IUPACcyclohexyl(diethoxyphosphoryl)methanol
SMILESCCOP(=O)(OCC)C(O)C1CCCCC1
InChIInChI=1S/C11H23O4P/c1-3-14-16(13,15-4-2)11(12)10-8-6-5-7-9-10/h10-12H,3-9H2,1-2H3
InChIKeyDACGZIQLRHYTPO-UHFFFAOYSA-N
MW250.27 g/mol
LogP3.15
Rot. Bonds6

About cyclohexyl(diethoxyphosphoryl)methanol

cyclohexyl(diethoxyphosphoryl)methanol (PubChem CID 15253198) has the molecular formula C11H23O4P and a molecular weight of 250.27 g/mol. Its IUPAC name is cyclohexyl(diethoxyphosphoryl)methanol.

Molecular Properties

Compound Namecyclohexyl(diethoxyphosphoryl)methanol
PubChem CID15253198
Molecular FormulaC11H23O4P
Molecular Weight250.27 g/mol
Exact Mass250.13
IUPAC Namecyclohexyl(diethoxyphosphoryl)methanol
SMILESCCOP(=O)(OCC)C(O)C1CCCCC1
InChIInChI=1S/C11H23O4P/c1-3-14-16(13,15-4-2)11(12)10-8-6-5-7-9-10/h10-12H,3-9H2,1-2H3
InChIKeyDACGZIQLRHYTPO-UHFFFAOYSA-N
XLogP3.15
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.27
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl(diethoxyphosphoryl)methanol?
The IUPAC name of cyclohexyl(diethoxyphosphoryl)methanol (CID 15253198) is cyclohexyl(diethoxyphosphoryl)methanol.
What is the SMILES notation for cyclohexyl(diethoxyphosphoryl)methanol?
The canonical SMILES for cyclohexyl(diethoxyphosphoryl)methanol is CCOP(=O)(OCC)C(O)C1CCCCC1.
What is the InChIKey of cyclohexyl(diethoxyphosphoryl)methanol?
The InChIKey is DACGZIQLRHYTPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23O4P/c1-3-14-16(13,15-4-2)11(12)10-8-6-5-7-9-10/h10-12H,3-9H2,1-2H3.
What are the key properties of cyclohexyl(diethoxyphosphoryl)methanol?
cyclohexyl(diethoxyphosphoryl)methanol has a molecular weight of 250.27 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl(diethoxyphosphoryl)methanol is sourced from PubChem (CID 15253198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).