tetrakis(3,3,3-trifluoroprop-1-ynyl)silane

C12F12Si — CID 91719489

IUPACtetrakis(3,3,3-trifluoroprop-1-ynyl)silane
SMILESFC(F)(F)C#C[Si](C#CC(F)(F)F)(C#CC(F)(F)F)C#CC(F)(F)F
InChIInChI=1S/C12F12Si/c13-9(14,15)1-5-25(6-2-10(16,17)18,7-3-11(19,20)21)8-4-12(22,23)24
InChIKeyUMVDWTFDRMQBOS-UHFFFAOYSA-N
MW400.19 g/mol
LogP3.85
Rot. Bonds

About tetrakis(3,3,3-trifluoroprop-1-ynyl)silane

tetrakis(3,3,3-trifluoroprop-1-ynyl)silane (PubChem CID 91719489) has the molecular formula C12F12Si and a molecular weight of 400.19 g/mol. Its IUPAC name is tetrakis(3,3,3-trifluoroprop-1-ynyl)silane.

Molecular Properties

Compound Nametetrakis(3,3,3-trifluoroprop-1-ynyl)silane
PubChem CID91719489
Molecular FormulaC12F12Si
Molecular Weight400.19 g/mol
Exact Mass399.96
IUPAC Nametetrakis(3,3,3-trifluoroprop-1-ynyl)silane
SMILESFC(F)(F)C#C[Si](C#CC(F)(F)F)(C#CC(F)(F)F)C#CC(F)(F)F
InChIInChI=1S/C12F12Si/c13-9(14,15)1-5-25(6-2-10(16,17)18,7-3-11(19,20)21)8-4-12(22,23)24
InChIKeyUMVDWTFDRMQBOS-UHFFFAOYSA-N
XLogP3.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.19
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,1,1,4,4,4-hexafluorobut-2-yne
CID 178077881
carbon monoxide;1,1,1,4,4,4-hexafluorobut-2-yne;ruthenium
CID 134981239
formaldehyde;1,1,1,4,4,4-hexafluorobut-2-yne;palladium
CID 173175881
pentafluoro(3,3,3-trifluoroprop-1-ynyl)-λ6-sulfane
CID 23237448
CID 10951512
CID 10951512
1,1,1,4,4,5,5,6-octafluorohex-2-yne
CID 87288466
1,1,1,4,4,5,5,6,6,7,7,7-dodecafluorohept-2-yne
CID 46898415
7,7,7-trifluoro-2-methylhepta-3,5-diyn-2-ol
CID 13418312
CID 5370978
CID 5370978
1,2-dichloro-4-(3,3,3-trifluoroprop-1-ynyl)benzene
CID 56958304
2-di(propan-2-yl)phosphanylethyl-di(propan-2-yl)phosphane;1,1,1,4,4,4-hexafluorobut-2-yne;nickel
CID 11016358
(2R)-1,1,1-trifluoro-2-methyl-4-trimethylsilylbut-3-yn-2-ol
CID 124635877

Frequently Asked Questions

What is the IUPAC name of tetrakis(3,3,3-trifluoroprop-1-ynyl)silane?
The IUPAC name of tetrakis(3,3,3-trifluoroprop-1-ynyl)silane (CID 91719489) is tetrakis(3,3,3-trifluoroprop-1-ynyl)silane.
What is the SMILES notation for tetrakis(3,3,3-trifluoroprop-1-ynyl)silane?
The canonical SMILES for tetrakis(3,3,3-trifluoroprop-1-ynyl)silane is FC(F)(F)C#C[Si](C#CC(F)(F)F)(C#CC(F)(F)F)C#CC(F)(F)F.
What is the InChIKey of tetrakis(3,3,3-trifluoroprop-1-ynyl)silane?
The InChIKey is UMVDWTFDRMQBOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12F12Si/c13-9(14,15)1-5-25(6-2-10(16,17)18,7-3-11(19,20)21)8-4-12(22,23)24.
What are the key properties of tetrakis(3,3,3-trifluoroprop-1-ynyl)silane?
tetrakis(3,3,3-trifluoroprop-1-ynyl)silane has a molecular weight of 400.19 g/mol, XLogP of 3.85, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(3,3,3-trifluoroprop-1-ynyl)silane is sourced from PubChem (CID 91719489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).