cyclohexyloxy(ethyl)phosphinic acid

C8H17O3P — CID 15397227

IUPACcyclohexyloxy(ethyl)phosphinic acid
SMILESCCP(=O)(O)OC1CCCCC1
InChIInChI=1S/C8H17O3P/c1-2-12(9,10)11-8-6-4-3-5-7-8/h8H,2-7H2,1H3,(H,9,10)
InChIKeyXJWMDTKDNBLJKV-UHFFFAOYSA-N
MW192.19 g/mol
LogP2.54
Rot. Bonds3

About cyclohexyloxy(ethyl)phosphinic acid

cyclohexyloxy(ethyl)phosphinic acid (PubChem CID 15397227) has the molecular formula C8H17O3P and a molecular weight of 192.19 g/mol. Its IUPAC name is cyclohexyloxy(ethyl)phosphinic acid.

Molecular Properties

Compound Namecyclohexyloxy(ethyl)phosphinic acid
PubChem CID15397227
Molecular FormulaC8H17O3P
Molecular Weight192.19 g/mol
Exact Mass192.09
IUPAC Namecyclohexyloxy(ethyl)phosphinic acid
SMILESCCP(=O)(O)OC1CCCCC1
InChIInChI=1S/C8H17O3P/c1-2-12(9,10)11-8-6-4-3-5-7-8/h8H,2-7H2,1H3,(H,9,10)
InChIKeyXJWMDTKDNBLJKV-UHFFFAOYSA-N
XLogP2.54
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 52.54
H-Bond Donors ≤ 51
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 cyclohexyloxy(ethyl)phosphinic acid?
The IUPAC name of cyclohexyloxy(ethyl)phosphinic acid (CID 15397227) is cyclohexyloxy(ethyl)phosphinic acid.
What is the SMILES notation for cyclohexyloxy(ethyl)phosphinic acid?
The canonical SMILES for cyclohexyloxy(ethyl)phosphinic acid is CCP(=O)(O)OC1CCCCC1.
What is the InChIKey of cyclohexyloxy(ethyl)phosphinic acid?
The InChIKey is XJWMDTKDNBLJKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17O3P/c1-2-12(9,10)11-8-6-4-3-5-7-8/h8H,2-7H2,1H3,(H,9,10).
What are the key properties of cyclohexyloxy(ethyl)phosphinic acid?
cyclohexyloxy(ethyl)phosphinic acid has a molecular weight of 192.19 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyloxy(ethyl)phosphinic acid is sourced from PubChem (CID 15397227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).