hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane

C10H25O2PPbS2 — CID 173386502

IUPAChydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane
SMILESCCCCCOP(O)(=S)SCCCCC.[PbH2]
InChIInChI=1S/C10H23O2PS2.Pb.2H/c1-3-5-7-9-12-13(11,14)15-10-8-6-4-2;;;/h3-10H2,1-2H3,(H,11,14);;;
InChIKeyLLEDATCBXYJVQE-UHFFFAOYSA-N
MW479.62 g/mol
LogP3.42
Rot. Bonds10

About hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane

hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane (PubChem CID 173386502) has the molecular formula C10H25O2PPbS2 and a molecular weight of 479.62 g/mol. Its IUPAC name is hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane.

Molecular Properties

Compound Namehydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane
PubChem CID173386502
Molecular FormulaC10H25O2PPbS2
Molecular Weight479.62 g/mol
Exact Mass480.08
IUPAC Namehydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane
SMILESCCCCCOP(O)(=S)SCCCCC.[PbH2]
InChIInChI=1S/C10H23O2PS2.Pb.2H/c1-3-5-7-9-12-13(11,14)15-10-8-6-4-2;;;/h3-10H2,1-2H3,(H,11,14);;;
InChIKeyLLEDATCBXYJVQE-UHFFFAOYSA-N
XLogP3.42
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500479.62
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;zinc
CID 87073414
hydroxy-sulfanylidene-triacontoxy-triacontylsulfanyl-λ5-phosphane
CID 161189025
hydroxy-octoxy-octylsulfanyl-sulfanylidene-λ5-phosphane;zinc
CID 87073233
hydroxy-nonoxy-nonylsulfanyl-sulfanylidene-λ5-phosphane;zinc
CID 87073286
hydroxy-octylsulfanyl-propoxy-sulfanylidene-λ5-phosphane
CID 174981933
didecoxy-decylsulfanyl-sulfanylidene-lambda5-phosphane
CID 12598537
octoxy-bis(octylsulfanyl)-sulfanylidene-λ5-phosphane
CID 54515285
CID 141192629
CID 141192629
dihydroxy-sulfanylidene-tetradecylsulfanyl-λ5-phosphane
CID 21217456
butoxy-hexoxy-hydroxy-sulfanylidene-λ5-phosphane
CID 89235788
1-[decylsulfanyl(dodecoxy)phosphoryl]oxydodecane
CID 88718866
1-[decoxy(octylsulfanyl)phosphoryl]oxydecane
CID 88718944

Frequently Asked Questions

What is the IUPAC name of hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane?
The IUPAC name of hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane (CID 173386502) is hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane.
What is the SMILES notation for hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane?
The canonical SMILES for hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane is CCCCCOP(O)(=S)SCCCCC.[PbH2].
What is the InChIKey of hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane?
The InChIKey is LLEDATCBXYJVQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23O2PS2.Pb.2H/c1-3-5-7-9-12-13(11,14)15-10-8-6-4-2;;;/h3-10H2,1-2H3,(H,11,14);;;.
What are the key properties of hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane?
hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane has a molecular weight of 479.62 g/mol, XLogP of 3.42, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-pentoxy-pentylsulfanyl-sulfanylidene-λ5-phosphane;λ2-plumbane is sourced from PubChem (CID 173386502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).