butyl-dichloro-selanylidene-λ5-phosphane

C4H9Cl2PSe — CID 23415657

IUPACbutyl-dichloro-selanylidene-λ5-phosphane
SMILESCCCCP(Cl)(Cl)=[Se]
InChIInChI=1S/C4H9Cl2PSe/c1-2-3-4-7(5,6)8/h2-4H2,1H3
InChIKeyVLLKHKGYSWUVIX-UHFFFAOYSA-N
MW237.96 g/mol
LogP3.20
Rot. Bonds3

About butyl-dichloro-selanylidene-λ5-phosphane

butyl-dichloro-selanylidene-λ5-phosphane (PubChem CID 23415657) has the molecular formula C4H9Cl2PSe and a molecular weight of 237.96 g/mol. Its IUPAC name is butyl-dichloro-selanylidene-λ5-phosphane.

Molecular Properties

Compound Namebutyl-dichloro-selanylidene-λ5-phosphane
PubChem CID23415657
Molecular FormulaC4H9Cl2PSe
Molecular Weight237.96 g/mol
Exact Mass237.90
IUPAC Namebutyl-dichloro-selanylidene-λ5-phosphane
SMILESCCCCP(Cl)(Cl)=[Se]
InChIInChI=1S/C4H9Cl2PSe/c1-2-3-4-7(5,6)8/h2-4H2,1H3
InChIKeyVLLKHKGYSWUVIX-UHFFFAOYSA-N
XLogP3.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.96
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

dichloro-ethyl-selanylidene-lambda5-phosphane
CID 518992
1-[chloro(methyl)phosphoryl]butane
CID 14592594
tridodecyl(selanylidene)-λ5-phosphane
CID 87250096
dibutyl-methyl-methylidene-λ5-phosphane
CID 59603144
dibutyl-(4,4-dibutyloctyl)-selanylidene-λ5-phosphane
CID 151301893
dichloro-hexyl-sulfanylidene-lambda5-phosphane
CID 12782644
[butyl(hydroxy)phosphoryl]azanide
CID 163826899
dibutylphosphorylmethanol
CID 5219006
beryllium;hexane;hydride
CID 173045264
CID 172720905
CID 172720905
1-[chloro(methyl)phosphoryl]tetradecane
CID 54104937
butylsulfanyl-chloro-ethyl-sulfanylidene-lambda5-phosphane
CID 15055139

Frequently Asked Questions

What is the IUPAC name of butyl-dichloro-selanylidene-λ5-phosphane?
The IUPAC name of butyl-dichloro-selanylidene-λ5-phosphane (CID 23415657) is butyl-dichloro-selanylidene-λ5-phosphane.
What is the SMILES notation for butyl-dichloro-selanylidene-λ5-phosphane?
The canonical SMILES for butyl-dichloro-selanylidene-λ5-phosphane is CCCCP(Cl)(Cl)=[Se].
What is the InChIKey of butyl-dichloro-selanylidene-λ5-phosphane?
The InChIKey is VLLKHKGYSWUVIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9Cl2PSe/c1-2-3-4-7(5,6)8/h2-4H2,1H3.
What are the key properties of butyl-dichloro-selanylidene-λ5-phosphane?
butyl-dichloro-selanylidene-λ5-phosphane has a molecular weight of 237.96 g/mol, XLogP of 3.20, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-dichloro-selanylidene-λ5-phosphane is sourced from PubChem (CID 23415657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).