methoxy-(1-methoxyethoxy)-oxophosphanium

C4H10O4P+ — CID 67892497

IUPACmethoxy-(1-methoxyethoxy)-oxophosphanium
SMILESCOC(C)O[P+](=O)OC
InChIInChI=1S/C4H10O4P/c1-4(6-2)8-9(5)7-3/h4H,1-3H3/q+1
InChIKeyBYXKNLJAGAUJNT-UHFFFAOYSA-N
MW153.09 g/mol
LogP1.30
Rot. Bonds4

About methoxy-(1-methoxyethoxy)-oxophosphanium

methoxy-(1-methoxyethoxy)-oxophosphanium (PubChem CID 67892497) has the molecular formula C4H10O4P+ and a molecular weight of 153.09 g/mol. Its IUPAC name is methoxy-(1-methoxyethoxy)-oxophosphanium.

Molecular Properties

Compound Namemethoxy-(1-methoxyethoxy)-oxophosphanium
PubChem CID67892497
Molecular FormulaC4H10O4P+
Molecular Weight153.09 g/mol
Exact Mass153.03
IUPAC Namemethoxy-(1-methoxyethoxy)-oxophosphanium
SMILESCOC(C)O[P+](=O)OC
InChIInChI=1S/C4H10O4P/c1-4(6-2)8-9(5)7-3/h4H,1-3H3/q+1
InChIKeyBYXKNLJAGAUJNT-UHFFFAOYSA-N
XLogP1.30
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.09
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methoxy-(1-methoxyethoxy)-oxophosphanium?
The IUPAC name of methoxy-(1-methoxyethoxy)-oxophosphanium (CID 67892497) is methoxy-(1-methoxyethoxy)-oxophosphanium.
What is the SMILES notation for methoxy-(1-methoxyethoxy)-oxophosphanium?
The canonical SMILES for methoxy-(1-methoxyethoxy)-oxophosphanium is COC(C)O[P+](=O)OC.
What is the InChIKey of methoxy-(1-methoxyethoxy)-oxophosphanium?
The InChIKey is BYXKNLJAGAUJNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O4P/c1-4(6-2)8-9(5)7-3/h4H,1-3H3/q+1.
What are the key properties of methoxy-(1-methoxyethoxy)-oxophosphanium?
methoxy-(1-methoxyethoxy)-oxophosphanium has a molecular weight of 153.09 g/mol, XLogP of 1.30, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-(1-methoxyethoxy)-oxophosphanium is sourced from PubChem (CID 67892497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).