[chlorooxy(ethyl)phosphoryl] hypochlorite

C2H5Cl2O3P — CID 139922572

IUPAC[chlorooxy(ethyl)phosphoryl] hypochlorite
SMILESCCP(=O)(OCl)OCl
InChIInChI=1S/C2H5Cl2O3P/c1-2-8(5,6-3)7-4/h2H2,1H3
InChIKeyUPBOBCPXKJCONK-UHFFFAOYSA-N
MW178.94 g/mol
LogP2.54
Rot. Bonds3

About [chlorooxy(ethyl)phosphoryl] hypochlorite

[chlorooxy(ethyl)phosphoryl] hypochlorite (PubChem CID 139922572) has the molecular formula C2H5Cl2O3P and a molecular weight of 178.94 g/mol. Its IUPAC name is [chlorooxy(ethyl)phosphoryl] hypochlorite.

Molecular Properties

Compound Name[chlorooxy(ethyl)phosphoryl] hypochlorite
PubChem CID139922572
Molecular FormulaC2H5Cl2O3P
Molecular Weight178.94 g/mol
Exact Mass177.94
IUPAC Name[chlorooxy(ethyl)phosphoryl] hypochlorite
SMILESCCP(=O)(OCl)OCl
InChIInChI=1S/C2H5Cl2O3P/c1-2-8(5,6-3)7-4/h2H2,1H3
InChIKeyUPBOBCPXKJCONK-UHFFFAOYSA-N
XLogP2.54
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.94
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[ethoxy(ethyl)phosphoryl] hypochlorite
CID 87057693
aluminum;chloro phosphate;ethanolate
CID 88806976
[acetyloxy(ethyl)phosphoryl] acetate
CID 173089018
2-dichlorooxyphosphorylethylphosphonic acid
CID 88640025
[chlorooxy(ethyl)phosphinothioyl] hypochlorite
CID 57051010
[chlorooxy(methyl)phosphoryl] hypochlorite
CID 23175688
2-[ethyl-[ethyl(propan-2-yloxy)phosphoryl]oxyphosphoryl]oxypropane
CID 134976793
dimethyl 2,3-bis[[ethyl(methoxy)phosphoryl]oxy]butanedioate
CID 88549328
carbonochloridic acid;[ethoxy(ethyl)phosphoryl]oxymethanol
CID 88813503
1-[dodecoxy(ethyl)phosphoryl]oxydodecane
CID 154323164
1-[ethyl(3-methylbutoxy)phosphoryl]oxy-3-methylbutane
CID 170851032
N-[acetamidooxy(ethyl)phosphoryl]oxyacetamide
CID 54217472

Frequently Asked Questions

What is the IUPAC name of [chlorooxy(ethyl)phosphoryl] hypochlorite?
The IUPAC name of [chlorooxy(ethyl)phosphoryl] hypochlorite (CID 139922572) is [chlorooxy(ethyl)phosphoryl] hypochlorite.
What is the SMILES notation for [chlorooxy(ethyl)phosphoryl] hypochlorite?
The canonical SMILES for [chlorooxy(ethyl)phosphoryl] hypochlorite is CCP(=O)(OCl)OCl.
What is the InChIKey of [chlorooxy(ethyl)phosphoryl] hypochlorite?
The InChIKey is UPBOBCPXKJCONK-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5Cl2O3P/c1-2-8(5,6-3)7-4/h2H2,1H3.
What are the key properties of [chlorooxy(ethyl)phosphoryl] hypochlorite?
[chlorooxy(ethyl)phosphoryl] hypochlorite has a molecular weight of 178.94 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [chlorooxy(ethyl)phosphoryl] hypochlorite is sourced from PubChem (CID 139922572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).