bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane

C19H17F5Si — CID 166636934

IUPACbis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane
SMILESC=C[Si](C=C)(CCCc1c(F)c(F)c(F)c(F)c1F)c1ccccc1
InChIInChI=1S/C19H17F5Si/c1-3-25(4-2,13-9-6-5-7-10-13)12-8-11-14-15(20)17(22)19(24)18(23)16(14)21/h3-7,9-10H,1-2,8,11-12H2
InChIKeyYYEWCIWPZNFTRP-UHFFFAOYSA-N
MW368.42 g/mol
LogP5.12
Rot. Bonds7

About bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane

bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane (PubChem CID 166636934) has the molecular formula C19H17F5Si and a molecular weight of 368.42 g/mol. Its IUPAC name is bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane.

Molecular Properties

Compound Namebis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane
PubChem CID166636934
Molecular FormulaC19H17F5Si
Molecular Weight368.42 g/mol
Exact Mass368.10
IUPAC Namebis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane
SMILESC=C[Si](C=C)(CCCc1c(F)c(F)c(F)c(F)c1F)c1ccccc1
InChIInChI=1S/C19H17F5Si/c1-3-25(4-2,13-9-6-5-7-10-13)12-8-11-14-15(20)17(22)19(24)18(23)16(14)21/h3-7,9-10H,1-2,8,11-12H2
InChIKeyYYEWCIWPZNFTRP-UHFFFAOYSA-N
XLogP5.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.42
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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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Frequently Asked Questions

What is the IUPAC name of bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane?
The IUPAC name of bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane (CID 166636934) is bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane.
What is the SMILES notation for bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane?
The canonical SMILES for bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane is C=C[Si](C=C)(CCCc1c(F)c(F)c(F)c(F)c1F)c1ccccc1.
What is the InChIKey of bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane?
The InChIKey is YYEWCIWPZNFTRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F5Si/c1-3-25(4-2,13-9-6-5-7-10-13)12-8-11-14-15(20)17(22)19(24)18(23)16(14)21/h3-7,9-10H,1-2,8,11-12H2.
What are the key properties of bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane?
bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane has a molecular weight of 368.42 g/mol, XLogP of 5.12, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(ethenyl)-[3-(2,3,4,5,6-pentafluorophenyl)propyl]-phenylsilane is sourced from PubChem (CID 166636934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).