formyloxy-methoxy-oxophosphanium

C2H4O4P+ — CID 57206869

IUPACformyloxy-methoxy-oxophosphanium
SMILESCO[P+](=O)OC=O
InChIInChI=1S/C2H4O4P/c1-5-7(4)6-2-3/h2H,1H3/q+1
InChIKeyGPTWTSSOXZXMNC-UHFFFAOYSA-N
MW123.02 g/mol
LogP0.46
Rot. Bonds3

About formyloxy-methoxy-oxophosphanium

formyloxy-methoxy-oxophosphanium (PubChem CID 57206869) has the molecular formula C2H4O4P+ and a molecular weight of 123.02 g/mol. Its IUPAC name is formyloxy-methoxy-oxophosphanium.

Molecular Properties

Compound Nameformyloxy-methoxy-oxophosphanium
PubChem CID57206869
Molecular FormulaC2H4O4P+
Molecular Weight123.02 g/mol
Exact Mass122.98
IUPAC Nameformyloxy-methoxy-oxophosphanium
SMILESCO[P+](=O)OC=O
InChIInChI=1S/C2H4O4P/c1-5-7(4)6-2-3/h2H,1H3/q+1
InChIKeyGPTWTSSOXZXMNC-UHFFFAOYSA-N
XLogP0.46
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.02
LogP ≤ 50.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of formyloxy-methoxy-oxophosphanium?
The IUPAC name of formyloxy-methoxy-oxophosphanium (CID 57206869) is formyloxy-methoxy-oxophosphanium.
What is the SMILES notation for formyloxy-methoxy-oxophosphanium?
The canonical SMILES for formyloxy-methoxy-oxophosphanium is CO[P+](=O)OC=O.
What is the InChIKey of formyloxy-methoxy-oxophosphanium?
The InChIKey is GPTWTSSOXZXMNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O4P/c1-5-7(4)6-2-3/h2H,1H3/q+1.
What are the key properties of formyloxy-methoxy-oxophosphanium?
formyloxy-methoxy-oxophosphanium has a molecular weight of 123.02 g/mol, XLogP of 0.46, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for formyloxy-methoxy-oxophosphanium is sourced from PubChem (CID 57206869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).