diethyl hydrogen phosphite

C4H11O3P — CID 12977

IUPACdiethyl hydrogen phosphite
SMILESCCOP(O)OCC
InChIInChI=1S/C4H11O3P/c1-3-6-8(5)7-4-2/h5H,3-4H2,1-2H3
InChIKeySULWMEGSVQCTSK-UHFFFAOYSA-N
MW138.10 g/mol
LogP1.28
Rot. Bonds4

About diethyl hydrogen phosphite

diethyl hydrogen phosphite (PubChem CID 12977) has the molecular formula C4H11O3P and a molecular weight of 138.10 g/mol. Its IUPAC name is diethyl hydrogen phosphite.

Molecular Properties

Compound Namediethyl hydrogen phosphite
PubChem CID12977
Molecular FormulaC4H11O3P
Molecular Weight138.10 g/mol
Exact Mass138.04
IUPAC Namediethyl hydrogen phosphite
SMILESCCOP(O)OCC
InChIInChI=1S/C4H11O3P/c1-3-6-8(5)7-4-2/h5H,3-4H2,1-2H3
InChIKeySULWMEGSVQCTSK-UHFFFAOYSA-N
XLogP1.28
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.10
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

diethyl hydrogen phosphite;mercury
CID 54602640
acetic acid;diethyl hydrogen phosphite;mercury
CID 21535
bromoethene;diethyl hydrogen phosphite
CID 88780762
azane;ethyl methyl hydrogen phosphite
CID 173447260
disodium;carbon monoxide;diethoxyphosphane;diethyl hydrogen phosphite;manganese
CID 11114554
diethyl hydrogen phosphite;toluene
CID 162138652
phosphorous acid;triethyl phosphite
CID 174300225
ethyl dihydrogen phosphite;dihydrochloride
CID 88746637
2-[ethoxy(hydroxy)phosphanyl]oxyethyl prop-2-enoate
CID 88743708
dibutyl hydrogen phosphite;phosphorous acid
CID 88648426
tetrakis(dibutyl hydrogen phosphite);silane
CID 175328252
ethoxy(trifluoromethyl)phosphinous acid
CID 171931307

Frequently Asked Questions

What is the IUPAC name of diethyl hydrogen phosphite?
The IUPAC name of diethyl hydrogen phosphite (CID 12977) is diethyl hydrogen phosphite.
What is the SMILES notation for diethyl hydrogen phosphite?
The canonical SMILES for diethyl hydrogen phosphite is CCOP(O)OCC.
What is the InChIKey of diethyl hydrogen phosphite?
The InChIKey is SULWMEGSVQCTSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11O3P/c1-3-6-8(5)7-4-2/h5H,3-4H2,1-2H3.
What are the key properties of diethyl hydrogen phosphite?
diethyl hydrogen phosphite has a molecular weight of 138.10 g/mol, XLogP of 1.28, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl hydrogen phosphite is sourced from PubChem (CID 12977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).