2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol

C6H14IO4P — CID 134275169

IUPAC2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol
SMILESOCCOCCOCCOPI
InChIInChI=1S/C6H14IO4P/c7-12-11-6-5-10-4-3-9-2-1-8/h8,12H,1-6H2
InChIKeyDYQBPFAMPRVLHU-UHFFFAOYSA-N
MW308.05 g/mol
LogP0.97
Rot. Bonds9

About 2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol

2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol (PubChem CID 134275169) has the molecular formula C6H14IO4P and a molecular weight of 308.05 g/mol. Its IUPAC name is 2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol
PubChem CID134275169
Molecular FormulaC6H14IO4P
Molecular Weight308.05 g/mol
Exact Mass307.97
IUPAC Name2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol
SMILESOCCOCCOCCOPI
InChIInChI=1S/C6H14IO4P/c7-12-11-6-5-10-4-3-9-2-1-8/h8,12H,1-6H2
InChIKeyDYQBPFAMPRVLHU-UHFFFAOYSA-N
XLogP0.97
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.05
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol?
The IUPAC name of 2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol (CID 134275169) is 2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol?
The canonical SMILES for 2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol is OCCOCCOCCOPI.
What is the InChIKey of 2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol?
The InChIKey is DYQBPFAMPRVLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14IO4P/c7-12-11-6-5-10-4-3-9-2-1-8/h8,12H,1-6H2.
What are the key properties of 2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol?
2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol has a molecular weight of 308.05 g/mol, XLogP of 0.97, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-iodophosphanyloxyethoxy)ethoxy]ethanol is sourced from PubChem (CID 134275169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).