dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane

Cl8N4P4 — CID 23413869

IUPACdichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane
SMILESClP(Cl)N1N(P(Cl)Cl)N(P(Cl)Cl)N1P(Cl)Cl
InChIInChI=1S/Cl8N4P4/c1-13(2)9-10(14(3)4)12(16(7)8)11(9)15(5)6
InChIKeyKLIDCWYJXQRLIB-UHFFFAOYSA-N
MW463.55 g/mol
LogP7.69
Rot. Bonds4

About dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane

dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane (PubChem CID 23413869) has the molecular formula Cl8N4P4 and a molecular weight of 463.55 g/mol. Its IUPAC name is dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane.

Molecular Properties

Compound Namedichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane
PubChem CID23413869
Molecular FormulaCl8N4P4
Molecular Weight463.55 g/mol
Exact Mass459.66
IUPAC Namedichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane
SMILESClP(Cl)N1N(P(Cl)Cl)N(P(Cl)Cl)N1P(Cl)Cl
InChIInChI=1S/Cl8N4P4/c1-13(2)9-10(14(3)4)12(16(7)8)11(9)15(5)6
InChIKeyKLIDCWYJXQRLIB-UHFFFAOYSA-N
XLogP7.69
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.55
LogP ≤ 57.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane?
The IUPAC name of dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane (CID 23413869) is dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane.
What is the SMILES notation for dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane?
The canonical SMILES for dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane is ClP(Cl)N1N(P(Cl)Cl)N(P(Cl)Cl)N1P(Cl)Cl.
What is the InChIKey of dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane?
The InChIKey is KLIDCWYJXQRLIB-UHFFFAOYSA-N. The full InChI is InChI=1S/Cl8N4P4/c1-13(2)9-10(14(3)4)12(16(7)8)11(9)15(5)6.
What are the key properties of dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane?
dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane has a molecular weight of 463.55 g/mol, XLogP of 7.69, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-[2,3,4-tris(dichlorophosphanyl)tetrazetidin-1-yl]phosphane is sourced from PubChem (CID 23413869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).