1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane

C10H24O5P2 — CID 586976

IUPAC1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane
SMILESCCCOP(=O)(OP(=O)(OC)C(C)C)C(C)C
InChIInChI=1S/C10H24O5P2/c1-7-8-14-17(12,10(4)5)15-16(11,13-6)9(2)3/h9-10H,7-8H2,1-6H3
InChIKeyUGLTWURFOJQCHK-UHFFFAOYSA-N
MW286.25 g/mol
LogP4.28
Rot. Bonds8

About 1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane

1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane (PubChem CID 586976) has the molecular formula C10H24O5P2 and a molecular weight of 286.25 g/mol. Its IUPAC name is 1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane.

Molecular Properties

Compound Name1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane
PubChem CID586976
Molecular FormulaC10H24O5P2
Molecular Weight286.25 g/mol
Exact Mass286.11
IUPAC Name1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane
SMILESCCCOP(=O)(OP(=O)(OC)C(C)C)C(C)C
InChIInChI=1S/C10H24O5P2/c1-7-8-14-17(12,10(4)5)15-16(11,13-6)9(2)3/h9-10H,7-8H2,1-6H3
InChIKeyUGLTWURFOJQCHK-UHFFFAOYSA-N
XLogP4.28
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.25
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-[butoxy(propan-2-yl)phosphoryl]oxybutane
CID 580343
1-[fluoro(propan-2-yl)phosphoryl]oxypropane
CID 581249
dimethoxyphosphoryl [methoxy(propan-2-yl)phosphoryl] methyl phosphate
CID 167268096
1-dipropoxyphosphoryl-N-methylethanamine
CID 71444705
1-[dimethoxyphosphoryl(propoxy)phosphoryl]oxypropane
CID 18430553
propyl phosphate;bis(tetramethylphosphanium)
CID 87474534
1-[butoxy-(2,2,2-trichloro-1-dimethoxyphosphorylethyl)phosphoryl]oxybutane
CID 10252324
1-[methoxy(propyl)phosphoryl]oxypropane
CID 587089
1-[methyl(propoxy)phosphoryl]oxypropane
CID 566276
1-dimethoxyphosphoryl-1-methoxybutane
CID 152537717
N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine
CID 541932
dibutoxyphosphorylmethanediol
CID 87672065

Frequently Asked Questions

What is the IUPAC name of 1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane?
The IUPAC name of 1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane (CID 586976) is 1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane.
What is the SMILES notation for 1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane?
The canonical SMILES for 1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane is CCCOP(=O)(OP(=O)(OC)C(C)C)C(C)C.
What is the InChIKey of 1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane?
The InChIKey is UGLTWURFOJQCHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24O5P2/c1-7-8-14-17(12,10(4)5)15-16(11,13-6)9(2)3/h9-10H,7-8H2,1-6H3.
What are the key properties of 1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane?
1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane has a molecular weight of 286.25 g/mol, XLogP of 4.28, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane is sourced from PubChem (CID 586976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).