[2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane

C23H50O6P2 — CID 23560463

IUPAC[2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane
SMILESCCOCCOCCOCCC(CCOCCOCCOCC)(CP(C)C)CP(C)C
InChIInChI=1S/C23H50O6P2/c1-7-24-13-15-28-19-17-26-11-9-23(21-30(3)4,22-31(5)6)10-12-27-18-20-29-16-14-25-8-2/h7-22H2,1-6H3
InChIKeyUXEBZCIMOSREMC-UHFFFAOYSA-N
MW484.60 g/mol
LogP4.38
Rot. Bonds24

About [2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane

[2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane (PubChem CID 23560463) has the molecular formula C23H50O6P2 and a molecular weight of 484.60 g/mol. Its IUPAC name is [2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane.

Molecular Properties

Compound Name[2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane
PubChem CID23560463
Molecular FormulaC23H50O6P2
Molecular Weight484.60 g/mol
Exact Mass484.31
IUPAC Name[2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane
SMILESCCOCCOCCOCCC(CCOCCOCCOCC)(CP(C)C)CP(C)C
InChIInChI=1S/C23H50O6P2/c1-7-24-13-15-28-19-17-26-11-9-23(21-30(3)4,22-31(5)6)10-12-27-18-20-29-16-14-25-8-2/h7-22H2,1-6H3
InChIKeyUXEBZCIMOSREMC-UHFFFAOYSA-N
XLogP4.38
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds24
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.60
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[2-(Dimethylphosphanylmethyl)-4-(2-propoxyethoxy)-2-[2-(2-propoxyethoxy)ethyl]butyl]-dimethylphosphane
CID 20712733
7,7,16,16-Tetramethyl-1,4,10,13-tetraoxacyclooctadecane
CID 59046060

Frequently Asked Questions

What is the IUPAC name of [2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane?
The IUPAC name of [2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane (CID 23560463) is [2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane.
What is the SMILES notation for [2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane?
The canonical SMILES for [2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane is CCOCCOCCOCCC(CCOCCOCCOCC)(CP(C)C)CP(C)C.
What is the InChIKey of [2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane?
The InChIKey is UXEBZCIMOSREMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H50O6P2/c1-7-24-13-15-28-19-17-26-11-9-23(21-30(3)4,22-31(5)6)10-12-27-18-20-29-16-14-25-8-2/h7-22H2,1-6H3.
What are the key properties of [2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane?
[2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane has a molecular weight of 484.60 g/mol, XLogP of 4.38, 24 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane is sourced from PubChem (CID 23560463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).