[diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate

C10H19O9PSn — CID 176650275

IUPAC[diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate
SMILESCOP(=O)(OC)C(C)[Sn](OC(C)=O)(OC(C)=O)OC(C)=O
InChIInChI=1S/C4H10O3P.3C2H4O2.Sn/c1-4-8(5,6-2)7-3;3*1-2(3)4;/h4H,1-3H3;3*1H3,(H,3,4);/q;;;;+3/p-3
InChIKeyFQWMOKBIGQOEAR-UHFFFAOYSA-K
MW432.94 g/mol
LogP1.03
Rot. Bonds7

About [diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate

[diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate (PubChem CID 176650275) has the molecular formula C10H19O9PSn and a molecular weight of 432.94 g/mol. Its IUPAC name is [diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate.

Molecular Properties

Compound Name[diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate
PubChem CID176650275
Molecular FormulaC10H19O9PSn
Molecular Weight432.94 g/mol
Exact Mass433.98
IUPAC Name[diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate
SMILESCOP(=O)(OC)C(C)[Sn](OC(C)=O)(OC(C)=O)OC(C)=O
InChIInChI=1S/C4H10O3P.3C2H4O2.Sn/c1-4-8(5,6-2)7-3;3*1-2(3)4;/h4H,1-3H3;3*1H3,(H,3,4);/q;;;;+3/p-3
InChIKeyFQWMOKBIGQOEAR-UHFFFAOYSA-K
XLogP1.03
TPSA114.43 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.94
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze [diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-dimethoxyphosphoryl-1-methoxypropan-2-one
CID 87461484
methyl 2-dimethoxyphosphorylpropanoate
CID 11019771
1-chloro-1-dimethoxyphosphorylpropan-2-one
CID 22399756
methyl (2S)-2-dimethoxyphosphorylpropanoate
CID 124577703
N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine
CID 12065471
1-dimethoxyphosphorylpropane-1,2-diol
CID 74820780
(1S,2S)-1-dimethoxyphosphorylpropane-1,2-diol
CID 42612314
N-[(1S,2R)-1-dimethoxyphosphoryl-2-hydroxy-3-methylbutyl]acetamide
CID 125471797
(2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol
CID 167170160
2-chloropropane;methyl acetate
CID 157293612
dimethoxyphosphoryl-bis(methylsulfanyl)methane
CID 5243976
(2-dimethoxyphosphoryl-1-phenylpropyl) acetate
CID 122399816

Frequently Asked Questions

What is the IUPAC name of [diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate?
The IUPAC name of [diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate (CID 176650275) is [diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate.
What is the SMILES notation for [diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate?
The canonical SMILES for [diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate is COP(=O)(OC)C(C)[Sn](OC(C)=O)(OC(C)=O)OC(C)=O.
What is the InChIKey of [diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate?
The InChIKey is FQWMOKBIGQOEAR-UHFFFAOYSA-K. The full InChI is InChI=1S/C4H10O3P.3C2H4O2.Sn/c1-4-8(5,6-2)7-3;3*1-2(3)4;/h4H,1-3H3;3*1H3,(H,3,4);/q;;;;+3/p-3.
What are the key properties of [diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate?
[diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate has a molecular weight of 432.94 g/mol, XLogP of 1.03, 7 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [diacetyloxy(1-dimethoxyphosphorylethyl)stannyl] acetate is sourced from PubChem (CID 176650275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).