difluoro-methyl-tridec-12-enylsilane

C14H28F2Si — CID 58758060

IUPACdifluoro-methyl-tridec-12-enylsilane
SMILESC=CCCCCCCCCCCC[Si](C)(F)F
InChIInChI=1S/C14H28F2Si/c1-3-4-5-6-7-8-9-10-11-12-13-14-17(2,15)16/h3H,1,4-14H2,2H3
InChIKeyVNBSWVSNJCBHSJ-UHFFFAOYSA-N
MW262.46 g/mol
LogP6.08
Rot. Bonds12

About difluoro-methyl-tridec-12-enylsilane

difluoro-methyl-tridec-12-enylsilane (PubChem CID 58758060) has the molecular formula C14H28F2Si and a molecular weight of 262.46 g/mol. Its IUPAC name is difluoro-methyl-tridec-12-enylsilane.

Molecular Properties

Compound Namedifluoro-methyl-tridec-12-enylsilane
PubChem CID58758060
Molecular FormulaC14H28F2Si
Molecular Weight262.46 g/mol
Exact Mass262.19
IUPAC Namedifluoro-methyl-tridec-12-enylsilane
SMILESC=CCCCCCCCCCCC[Si](C)(F)F
InChIInChI=1S/C14H28F2Si/c1-3-4-5-6-7-8-9-10-11-12-13-14-17(2,15)16/h3H,1,4-14H2,2H3
InChIKeyVNBSWVSNJCBHSJ-UHFFFAOYSA-N
XLogP6.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.46
LogP ≤ 56.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

fluoro-[(E)-hept-1-enyl]-dimethylsilane
CID 101731019
(e)-1-Trifluorosilyl-1-octene
CID 10878076
(e)-1-(Dimethylfluorosilyl)-1-octene
CID 10943246
difluoro-methyl-[(E)-oct-1-enyl]silane
CID 14617628
Silane, trimethyl-1-octenyl-, (E)-
CID 5365375
[(Z)-dec-1-enyl]-fluoro-dimethylsilane
CID 11148648
difluoro-methyl-[(Z)-oct-1-enyl]silane
CID 14617629
trans-1-(Triethylsilyl)hept-1-ene
CID 5374904
trimethyl-[(Z)-oct-1-enyl]silane
CID 12426821
[(E)-dec-2-enyl]-trimethylsilane
CID 13776256
cis,trans-Octenyltriethylsilane
CID 10955287
[(Z)-dodec-1-enyl]-triethylsilane
CID 11033344

Frequently Asked Questions

What is the IUPAC name of difluoro-methyl-tridec-12-enylsilane?
The IUPAC name of difluoro-methyl-tridec-12-enylsilane (CID 58758060) is difluoro-methyl-tridec-12-enylsilane.
What is the SMILES notation for difluoro-methyl-tridec-12-enylsilane?
The canonical SMILES for difluoro-methyl-tridec-12-enylsilane is C=CCCCCCCCCCCC[Si](C)(F)F.
What is the InChIKey of difluoro-methyl-tridec-12-enylsilane?
The InChIKey is VNBSWVSNJCBHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28F2Si/c1-3-4-5-6-7-8-9-10-11-12-13-14-17(2,15)16/h3H,1,4-14H2,2H3.
What are the key properties of difluoro-methyl-tridec-12-enylsilane?
difluoro-methyl-tridec-12-enylsilane has a molecular weight of 262.46 g/mol, XLogP of 6.08, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for difluoro-methyl-tridec-12-enylsilane is sourced from PubChem (CID 58758060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).