cerium;phosphorosooxymethane

CH3CeO2P — CID 175404403

IUPACcerium;phosphorosooxymethane
SMILESCOP=O.[Ce]
InChIInChI=1S/CH3O2P.Ce/c1-3-4-2;/h1H3;
InChIKeyPLGRRYWUUIIHKX-UHFFFAOYSA-N
MW218.12 g/mol
LogP0.84
Rot. Bonds1

About cerium;phosphorosooxymethane

cerium;phosphorosooxymethane (PubChem CID 175404403) has the molecular formula CH3CeO2P and a molecular weight of 218.12 g/mol. Its IUPAC name is cerium;phosphorosooxymethane.

Molecular Properties

Compound Namecerium;phosphorosooxymethane
PubChem CID175404403
Molecular FormulaCH3CeO2P
Molecular Weight218.12 g/mol
Exact Mass217.89
IUPAC Namecerium;phosphorosooxymethane
SMILESCOP=O.[Ce]
InChIInChI=1S/CH3O2P.Ce/c1-3-4-2;/h1H3;
InChIKeyPLGRRYWUUIIHKX-UHFFFAOYSA-N
XLogP0.84
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.12
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

sodium;hydride;phosphorosooxymethane
CID 174594541
Hydroperoxyphosphanone
CID 18990785
(phosphorosoamino)oxymethane
CID 174499724
1-phosphorosooxybutane;propane
CID 88827784
alumane;1-phosphorosooxypentane
CID 174749996
1-phosphorosooxyoctadecane
CID 23002272
alumane;phosphorosooxyphosphane
CID 174818054
[butyl(dimethoxy)silyl]oxymethylidyne-oxo-λ5-phosphane
CID 174500866
alumane;2-methoxy-1-phosphorosooxypropane
CID 175063077
sodium;hydride;1-phosphorosooxypentane
CID 173010911
1-(2-phosphorosooxyethoxy)butane
CID 54124788
sodium;hydride;1-phosphorosooxyoctane
CID 173400721

Frequently Asked Questions

What is the IUPAC name of cerium;phosphorosooxymethane?
The IUPAC name of cerium;phosphorosooxymethane (CID 175404403) is cerium;phosphorosooxymethane.
What is the SMILES notation for cerium;phosphorosooxymethane?
The canonical SMILES for cerium;phosphorosooxymethane is COP=O.[Ce].
What is the InChIKey of cerium;phosphorosooxymethane?
The InChIKey is PLGRRYWUUIIHKX-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3O2P.Ce/c1-3-4-2;/h1H3;.
What are the key properties of cerium;phosphorosooxymethane?
cerium;phosphorosooxymethane has a molecular weight of 218.12 g/mol, XLogP of 0.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cerium;phosphorosooxymethane is sourced from PubChem (CID 175404403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).