2-ethyl-2-iodophosphanyloxybutan-1-ol

C6H14IO2P — CID 157032032

IUPAC2-ethyl-2-iodophosphanyloxybutan-1-ol
SMILESCCC(CC)(CO)OPI
InChIInChI=1S/C6H14IO2P/c1-3-6(4-2,5-8)9-10-7/h8,10H,3-5H2,1-2H3
InChIKeyGLTGXIRWEWALOL-UHFFFAOYSA-N
MW276.05 g/mol
LogP2.50
Rot. Bonds5

About 2-ethyl-2-iodophosphanyloxybutan-1-ol

2-ethyl-2-iodophosphanyloxybutan-1-ol (PubChem CID 157032032) has the molecular formula C6H14IO2P and a molecular weight of 276.05 g/mol. Its IUPAC name is 2-ethyl-2-iodophosphanyloxybutan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-iodophosphanyloxybutan-1-ol
PubChem CID157032032
Molecular FormulaC6H14IO2P
Molecular Weight276.05 g/mol
Exact Mass275.98
IUPAC Name2-ethyl-2-iodophosphanyloxybutan-1-ol
SMILESCCC(CC)(CO)OPI
InChIInChI=1S/C6H14IO2P/c1-3-6(4-2,5-8)9-10-7/h8,10H,3-5H2,1-2H3
InChIKeyGLTGXIRWEWALOL-UHFFFAOYSA-N
XLogP2.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.05
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-2-prop-2-enoxypropane-1,3-diol
CID 11457842
3-ethylheptan-3-yloxyphosphinous acid
CID 141201848
2-ethyl-2-[3-(1-hydroxy-2-methylprop-2-enoxy)propoxy]propane-1,3-diol
CID 58836384
2-ethyl-2-[5-[methyl-bis(trimethylsilyloxy)silyl]pentoxy]propane-1,3-diol
CID 140891436
2-(1-hydroxy-2-methylbutan-2-yl)oxy-2-propylpropane-1,3-diol
CID 89255571
ethanol;ruthenium
CID 150841781
ethanol;ruthenium
CID 157358792
2-(hydroxymethyl)-2-[[iodo(trimethyl)-λ5-phosphanyl]methyl]propane-1,3-diol
CID 166063381
ethoxyethane;2-(hydroxymethyl)-2-methylpropane-1,3-diol
CID 21464807
2-ethyl-2-(iodomethyl)propane-1,3-diol
CID 118585787
2-[3-[dimethyl(trimethylsilyloxy)silyl]propoxy]-2-[[2-[3-[dimethyl(trimethylsilyloxy)silyl]propoxy]-2-(hydroxymethyl)butyl]peroxymethyl]butan-1-ol;methane
CID 123576942
alumane;2-ethyl-2-(hydroxymethyl)propane-1,3-diol
CID 175039702

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-iodophosphanyloxybutan-1-ol?
The IUPAC name of 2-ethyl-2-iodophosphanyloxybutan-1-ol (CID 157032032) is 2-ethyl-2-iodophosphanyloxybutan-1-ol.
What is the SMILES notation for 2-ethyl-2-iodophosphanyloxybutan-1-ol?
The canonical SMILES for 2-ethyl-2-iodophosphanyloxybutan-1-ol is CCC(CC)(CO)OPI.
What is the InChIKey of 2-ethyl-2-iodophosphanyloxybutan-1-ol?
The InChIKey is GLTGXIRWEWALOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14IO2P/c1-3-6(4-2,5-8)9-10-7/h8,10H,3-5H2,1-2H3.
What are the key properties of 2-ethyl-2-iodophosphanyloxybutan-1-ol?
2-ethyl-2-iodophosphanyloxybutan-1-ol has a molecular weight of 276.05 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-iodophosphanyloxybutan-1-ol is sourced from PubChem (CID 157032032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).