trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane

C20H39F3Si — CID 139683805

IUPACtrifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane
SMILESC/C(=C\C[Si](F)(F)F)CCC[C@H](C)CCC[C@H](C)CCCC(C)C
InChIInChI=1S/C20H39F3Si/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-24(21,22)23/h15,17-19H,6-14,16H2,1-5H3/b20-15+/t18-,19-/m1/s1
InChIKeyVZTGJONMKICLFS-PYDDKJGSSA-N
MW364.61 g/mol
LogP8.22
Rot. Bonds14

About trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane

trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane (PubChem CID 139683805) has the molecular formula C20H39F3Si and a molecular weight of 364.61 g/mol. Its IUPAC name is trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane.

Molecular Properties

Compound Nametrifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane
PubChem CID139683805
Molecular FormulaC20H39F3Si
Molecular Weight364.61 g/mol
Exact Mass364.28
IUPAC Nametrifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane
SMILESC/C(=C\C[Si](F)(F)F)CCC[C@H](C)CCC[C@H](C)CCCC(C)C
InChIInChI=1S/C20H39F3Si/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-24(21,22)23/h15,17-19H,6-14,16H2,1-5H3/b20-15+/t18-,19-/m1/s1
InChIKeyVZTGJONMKICLFS-PYDDKJGSSA-N
XLogP8.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.61
LogP ≤ 58.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3,7,11,15-Tetramethyl-2-hexadecene
CID 5366161
Phyt-2-ene
CID 6428766
Tetraisobutylene
CID 56846471
2,6,10,14-Tetramethyl-2-hexadecene
CID 521742
3,7,11,15-Tetramethyl-n-hexadec-2-ene
CID 550890
Cubitene
CID 101316901
(6R)-2,6-dimethyltetradec-2-ene
CID 13985754
(1E,5E,8S,10R)-1,5-dimethyl-8,10-bis(prop-1-en-2-yl)cyclododeca-1,5-diene
CID 10516348
(6E,10E,14E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14-tetraene
CID 129652146
(6Z,10E,14E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14-tetraene
CID 129688342
Octahydrosqualene
CID 129694594
Hexahydrosqualene
CID 129694601

Frequently Asked Questions

What is the IUPAC name of trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane?
The IUPAC name of trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane (CID 139683805) is trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane.
What is the SMILES notation for trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane?
The canonical SMILES for trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane is C/C(=C\C[Si](F)(F)F)CCC[C@H](C)CCC[C@H](C)CCCC(C)C.
What is the InChIKey of trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane?
The InChIKey is VZTGJONMKICLFS-PYDDKJGSSA-N. The full InChI is InChI=1S/C20H39F3Si/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-24(21,22)23/h15,17-19H,6-14,16H2,1-5H3/b20-15+/t18-,19-/m1/s1.
What are the key properties of trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane?
trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane has a molecular weight of 364.61 g/mol, XLogP of 8.22, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trifluoro-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]silane is sourced from PubChem (CID 139683805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).