(2S)-2-(10-diethoxyphosphoryldecoxy)oxolane

C18H37O5P — CID 129383709

IUPAC(2S)-2-(10-diethoxyphosphoryldecoxy)oxolane
SMILESCCOP(=O)(CCCCCCCCCCO[C@H]1CCCO1)OCC
InChIInChI=1S/C18H37O5P/c1-3-22-24(19,23-4-2)17-12-10-8-6-5-7-9-11-15-20-18-14-13-16-21-18/h18H,3-17H2,1-2H3/t18-/m1/s1
InChIKeyZOLJYJCPHUWMOG-GOSISDBHSA-N
MW364.46 g/mol
LogP5.53
Rot. Bonds16

About (2S)-2-(10-diethoxyphosphoryldecoxy)oxolane

(2S)-2-(10-diethoxyphosphoryldecoxy)oxolane (PubChem CID 129383709) has the molecular formula C18H37O5P and a molecular weight of 364.46 g/mol. Its IUPAC name is (2S)-2-(10-diethoxyphosphoryldecoxy)oxolane.

Molecular Properties

Compound Name(2S)-2-(10-diethoxyphosphoryldecoxy)oxolane
PubChem CID129383709
Molecular FormulaC18H37O5P
Molecular Weight364.46 g/mol
Exact Mass364.24
IUPAC Name(2S)-2-(10-diethoxyphosphoryldecoxy)oxolane
SMILESCCOP(=O)(CCCCCCCCCCO[C@H]1CCCO1)OCC
InChIInChI=1S/C18H37O5P/c1-3-22-24(19,23-4-2)17-12-10-8-6-5-7-9-11-15-20-18-14-13-16-21-18/h18H,3-17H2,1-2H3/t18-/m1/s1
InChIKeyZOLJYJCPHUWMOG-GOSISDBHSA-N
XLogP5.53
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds16
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.46
LogP ≤ 55.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (2S)-2-(10-diethoxyphosphoryldecoxy)oxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-diethoxyphosphoryl-9-(oxan-2-yloxy)nonan-2-one
CID 121355402
2-octacosoxyoxane
CID 11214102
2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane
CID 155771365
18-(oxan-2-yloxy)octadecylphosphanium iodide
CID 157231904
2-(12-bromododecoxy)oxane
CID 11078592
2-[4,4-bis[di(propan-2-yloxy)phosphoryl]butoxy]oxane
CID 91259156
trimethyl-[13-(oxan-2-yloxy)tridecyl]silane
CID 86200856
Methylbis{6-[(oxan-2-yl)oxy]hexyl}silane
CID 78062562
2-(6-methylheptoxy)oxane
CID 139685112
magnesium;2-ethoxyoxane;dichloride
CID 158421621
13-[(2S)-oxan-2-yl]oxytridecan-2-one
CID 129363277
2-[2-[2-[2-[11-(oxan-2-yloxy)undecoxy]ethoxy]ethoxy]ethoxy]ethyl methanesulfonate
CID 142550860

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(10-diethoxyphosphoryldecoxy)oxolane?
The IUPAC name of (2S)-2-(10-diethoxyphosphoryldecoxy)oxolane (CID 129383709) is (2S)-2-(10-diethoxyphosphoryldecoxy)oxolane.
What is the SMILES notation for (2S)-2-(10-diethoxyphosphoryldecoxy)oxolane?
The canonical SMILES for (2S)-2-(10-diethoxyphosphoryldecoxy)oxolane is CCOP(=O)(CCCCCCCCCCO[C@H]1CCCO1)OCC.
What is the InChIKey of (2S)-2-(10-diethoxyphosphoryldecoxy)oxolane?
The InChIKey is ZOLJYJCPHUWMOG-GOSISDBHSA-N. The full InChI is InChI=1S/C18H37O5P/c1-3-22-24(19,23-4-2)17-12-10-8-6-5-7-9-11-15-20-18-14-13-16-21-18/h18H,3-17H2,1-2H3/t18-/m1/s1.
What are the key properties of (2S)-2-(10-diethoxyphosphoryldecoxy)oxolane?
(2S)-2-(10-diethoxyphosphoryldecoxy)oxolane has a molecular weight of 364.46 g/mol, XLogP of 5.53, 16 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(10-diethoxyphosphoryldecoxy)oxolane is sourced from PubChem (CID 129383709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).