(2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane

C30H20F5OSb — CID 133065134

IUPAC(2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane
SMILESFc1c(F)c(F)c(O[Sb](c2ccccc2)(c2ccccc2)(c2ccccc2)c2ccccc2)c(F)c1F
InChIInChI=1S/C6HF5O.4C6H5.Sb/c7-1-2(8)4(10)6(12)5(11)3(1)9;4*1-2-4-6-5-3-1;/h12H;4*1-5H;/q;;;;;+1/p-1
InChIKeyBNFFLINTXYSCQR-UHFFFAOYSA-M
MW613.24 g/mol
LogP5.29
Rot. Bonds6

About (2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane

(2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane (PubChem CID 133065134) has the molecular formula C30H20F5OSb and a molecular weight of 613.24 g/mol. Its IUPAC name is (2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane.

Molecular Properties

Compound Name(2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane
PubChem CID133065134
Molecular FormulaC30H20F5OSb
Molecular Weight613.24 g/mol
Exact Mass612.05
IUPAC Name(2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane
SMILESFc1c(F)c(F)c(O[Sb](c2ccccc2)(c2ccccc2)(c2ccccc2)c2ccccc2)c(F)c1F
InChIInChI=1S/C6HF5O.4C6H5.Sb/c7-1-2(8)4(10)6(12)5(11)3(1)9;4*1-2-4-6-5-3-1;/h12H;4*1-5H;/q;;;;;+1/p-1
InChIKeyBNFFLINTXYSCQR-UHFFFAOYSA-M
XLogP5.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500613.24
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tetrakis(4-methylphenyl)-(2,3,4,5,6-pentafluorophenoxy)-λ5-stibane
CID 133064666
(tetraphenyl-λ5-stibanyl) acetate
CID 16699436
1,2,4,5-tetrafluoro-3,6-diphenoxybenzene
CID 679714
benzhydrylbenzene;tetrakis((2,3,4,5,6-pentafluorophenoxy)boronic acid)
CID 173177693
6-oxo-6-(2,3,4,5,6-pentafluorophenoxy)-4-phenylhexanoic acid
CID 14938949
bis(tetraphenyl-λ5-stibanyl) benzene-1,2-dicarboxylate
CID 16716661
bis(tetraphenyl-λ5-stibanyl) propanedioate
CID 16714240
dioxido-(2,3,4,5,6-pentafluorophenoxy)borane;bis(diphenylmethylbenzene)
CID 87833366
sodium (2,3,4,5,6-pentafluorophenyl)-triphenylboranuide
CID 139835857
N,N-dimethylaniline;tetrakis((2,3,4,5,6-pentafluorophenoxy)boronic acid)
CID 172817578
bis(2,3,4,5,6-pentafluorophenoxy)borinic acid;N,N-dimethylaniline
CID 162232157
1-N,4-N-diphenyl-1-N,4-N-bis[4-[2,3,5,6-tetrafluoro-4-(2,3,4,5,6-pentafluorophenyl)phenoxy]phenyl]benzene-1,4-diamine
CID 138724935

Frequently Asked Questions

What is the IUPAC name of (2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane?
The IUPAC name of (2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane (CID 133065134) is (2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane.
What is the SMILES notation for (2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane?
The canonical SMILES for (2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane is Fc1c(F)c(F)c(O[Sb](c2ccccc2)(c2ccccc2)(c2ccccc2)c2ccccc2)c(F)c1F.
What is the InChIKey of (2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane?
The InChIKey is BNFFLINTXYSCQR-UHFFFAOYSA-M. The full InChI is InChI=1S/C6HF5O.4C6H5.Sb/c7-1-2(8)4(10)6(12)5(11)3(1)9;4*1-2-4-6-5-3-1;/h12H;4*1-5H;/q;;;;;+1/p-1.
What are the key properties of (2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane?
(2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane has a molecular weight of 613.24 g/mol, XLogP of 5.29, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3,4,5,6-pentafluorophenoxy)-tetraphenyl-λ5-stibane is sourced from PubChem (CID 133065134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).