hydroxymethoxy-oxido-oxophosphanium

CH3O4P — CID 152749176

IUPAChydroxymethoxy-oxido-oxophosphanium
SMILESO=[P+]([O-])OCO
InChIInChI=1S/CH3O4P/c2-1-5-6(3)4/h2H,1H2
InChIKeyCEJYYWYHIXCHTA-UHFFFAOYSA-N
MW110.00 g/mol
LogP-1.03
Rot. Bonds2

About hydroxymethoxy-oxido-oxophosphanium

hydroxymethoxy-oxido-oxophosphanium (PubChem CID 152749176) has the molecular formula CH3O4P and a molecular weight of 110.00 g/mol. Its IUPAC name is hydroxymethoxy-oxido-oxophosphanium.

Molecular Properties

Compound Namehydroxymethoxy-oxido-oxophosphanium
PubChem CID152749176
Molecular FormulaCH3O4P
Molecular Weight110.00 g/mol
Exact Mass109.98
IUPAC Namehydroxymethoxy-oxido-oxophosphanium
SMILESO=[P+]([O-])OCO
InChIInChI=1S/CH3O4P/c2-1-5-6(3)4/h2H,1H2
InChIKeyCEJYYWYHIXCHTA-UHFFFAOYSA-N
XLogP-1.03
TPSA69.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.00
LogP ≤ 5-1.03
H-Bond Donors ≤ 51
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 hydroxymethoxy-oxido-oxophosphanium?
The IUPAC name of hydroxymethoxy-oxido-oxophosphanium (CID 152749176) is hydroxymethoxy-oxido-oxophosphanium.
What is the SMILES notation for hydroxymethoxy-oxido-oxophosphanium?
The canonical SMILES for hydroxymethoxy-oxido-oxophosphanium is O=[P+]([O-])OCO.
What is the InChIKey of hydroxymethoxy-oxido-oxophosphanium?
The InChIKey is CEJYYWYHIXCHTA-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3O4P/c2-1-5-6(3)4/h2H,1H2.
What are the key properties of hydroxymethoxy-oxido-oxophosphanium?
hydroxymethoxy-oxido-oxophosphanium has a molecular weight of 110.00 g/mol, XLogP of -1.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxymethoxy-oxido-oxophosphanium is sourced from PubChem (CID 152749176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).