tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane

C24F20O4Sn — CID 18626831

IUPACtetrakis(2,3,4,5,6-pentafluorophenoxy)stannane
SMILESFc1c(F)c(F)c(O[Sn](Oc2c(F)c(F)c(F)c(F)c2F)(Oc2c(F)c(F)c(F)c(F)c2F)Oc2c(F)c(F)c(F)c(F)c2F)c(F)c1F
InChIInChI=1S/4C6HF5O.Sn/c4*7-1-2(8)4(10)6(12)5(11)3(1)9;/h4*12H;/q;;;;+4/p-4
InChIKeyPURLTLPBLPDUOS-UHFFFAOYSA-J
MW850.93 g/mol
LogP8.52
Rot. Bonds8

About tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane

tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane (PubChem CID 18626831) has the molecular formula C24F20O4Sn and a molecular weight of 850.93 g/mol. Its IUPAC name is tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane.

Molecular Properties

Compound Nametetrakis(2,3,4,5,6-pentafluorophenoxy)stannane
PubChem CID18626831
Molecular FormulaC24F20O4Sn
Molecular Weight850.93 g/mol
Exact Mass851.85
IUPAC Nametetrakis(2,3,4,5,6-pentafluorophenoxy)stannane
SMILESFc1c(F)c(F)c(O[Sn](Oc2c(F)c(F)c(F)c(F)c2F)(Oc2c(F)c(F)c(F)c(F)c2F)Oc2c(F)c(F)c(F)c(F)c2F)c(F)c1F
InChIInChI=1S/4C6HF5O.Sn/c4*7-1-2(8)4(10)6(12)5(11)3(1)9;/h4*12H;/q;;;;+4/p-4
InChIKeyPURLTLPBLPDUOS-UHFFFAOYSA-J
XLogP8.52
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500850.93
LogP ≤ 58.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane?
The IUPAC name of tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane (CID 18626831) is tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane.
What is the SMILES notation for tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane?
The canonical SMILES for tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane is Fc1c(F)c(F)c(O[Sn](Oc2c(F)c(F)c(F)c(F)c2F)(Oc2c(F)c(F)c(F)c(F)c2F)Oc2c(F)c(F)c(F)c(F)c2F)c(F)c1F.
What is the InChIKey of tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane?
The InChIKey is PURLTLPBLPDUOS-UHFFFAOYSA-J. The full InChI is InChI=1S/4C6HF5O.Sn/c4*7-1-2(8)4(10)6(12)5(11)3(1)9;/h4*12H;/q;;;;+4/p-4.
What are the key properties of tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane?
tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane has a molecular weight of 850.93 g/mol, XLogP of 8.52, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(2,3,4,5,6-pentafluorophenoxy)stannane is sourced from PubChem (CID 18626831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).