dimethoxymethyl(dimethoxy)phosphane

C5H13O4P — CID 12601975

IUPACdimethoxymethyl(dimethoxy)phosphane
SMILESCOC(OC)P(OC)OC
InChIInChI=1S/C5H13O4P/c1-6-5(7-2)10(8-3)9-4/h5H,1-4H3
InChIKeyNXDOBYSAWLRPSK-UHFFFAOYSA-N
MW168.13 g/mol
LogP1.17
Rot. Bonds5

About dimethoxymethyl(dimethoxy)phosphane

dimethoxymethyl(dimethoxy)phosphane (PubChem CID 12601975) has the molecular formula C5H13O4P and a molecular weight of 168.13 g/mol. Its IUPAC name is dimethoxymethyl(dimethoxy)phosphane.

Molecular Properties

Compound Namedimethoxymethyl(dimethoxy)phosphane
PubChem CID12601975
Molecular FormulaC5H13O4P
Molecular Weight168.13 g/mol
Exact Mass168.06
IUPAC Namedimethoxymethyl(dimethoxy)phosphane
SMILESCOC(OC)P(OC)OC
InChIInChI=1S/C5H13O4P/c1-6-5(7-2)10(8-3)9-4/h5H,1-4H3
InChIKeyNXDOBYSAWLRPSK-UHFFFAOYSA-N
XLogP1.17
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.13
LogP ≤ 51.17
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 dimethoxymethyl(dimethoxy)phosphane?
The IUPAC name of dimethoxymethyl(dimethoxy)phosphane (CID 12601975) is dimethoxymethyl(dimethoxy)phosphane.
What is the SMILES notation for dimethoxymethyl(dimethoxy)phosphane?
The canonical SMILES for dimethoxymethyl(dimethoxy)phosphane is COC(OC)P(OC)OC.
What is the InChIKey of dimethoxymethyl(dimethoxy)phosphane?
The InChIKey is NXDOBYSAWLRPSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13O4P/c1-6-5(7-2)10(8-3)9-4/h5H,1-4H3.
What are the key properties of dimethoxymethyl(dimethoxy)phosphane?
dimethoxymethyl(dimethoxy)phosphane has a molecular weight of 168.13 g/mol, XLogP of 1.17, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxymethyl(dimethoxy)phosphane is sourced from PubChem (CID 12601975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).