but-3-enyl-methyl-octadec-17-enylsilylsilane

C23H48Si2 — CID 173227463

IUPACbut-3-enyl-methyl-octadec-17-enylsilylsilane
SMILESC=CCCCCCCCCCCCCCCCC[SiH2][SiH](C)CCC=C
InChIInChI=1S/C23H48Si2/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-25(3)23-7-5-2/h4-5,25H,1-2,6-24H2,3H3
InChIKeyBAPKIVLFNVJYGK-UHFFFAOYSA-N
MW380.81 g/mol
LogP7.54
Rot. Bonds21

About but-3-enyl-methyl-octadec-17-enylsilylsilane

but-3-enyl-methyl-octadec-17-enylsilylsilane (PubChem CID 173227463) has the molecular formula C23H48Si2 and a molecular weight of 380.81 g/mol. Its IUPAC name is but-3-enyl-methyl-octadec-17-enylsilylsilane.

Molecular Properties

Compound Namebut-3-enyl-methyl-octadec-17-enylsilylsilane
PubChem CID173227463
Molecular FormulaC23H48Si2
Molecular Weight380.81 g/mol
Exact Mass380.33
IUPAC Namebut-3-enyl-methyl-octadec-17-enylsilylsilane
SMILESC=CCCCCCCCCCCCCCCCC[SiH2][SiH](C)CCC=C
InChIInChI=1S/C23H48Si2/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-25(3)23-7-5-2/h4-5,25H,1-2,6-24H2,3H3
InChIKeyBAPKIVLFNVJYGK-UHFFFAOYSA-N
XLogP7.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds21
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.81
LogP ≤ 57.54
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'}

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Related Compounds

heptacosa-1,26-diene
CID 58905535
heptadeca-1,16-diene
CID 6429392
prop-2-enyl(undec-10-enyl)silane
CID 173097266
2-methylprop-1-enyl(oct-7-enyl)silane
CID 154093465
octadecane;octadec-1-ene
CID 162018238
octadeca-1,17-diene;tetradec-1-ene
CID 173070986
octadec-1-ene;tetradec-1-ene
CID 158470925
heptadec-16-en-1-amine
CID 15590771
non-1-ene
CID 141296734
hexane;octadec-1-ene
CID 175577514
dec-1-ene;dodec-1-ene;tetradec-1-ene
CID 159177706
hexadec-15-enyl(dimethoxy)silane
CID 172819817

Frequently Asked Questions

What is the IUPAC name of but-3-enyl-methyl-octadec-17-enylsilylsilane?
The IUPAC name of but-3-enyl-methyl-octadec-17-enylsilylsilane (CID 173227463) is but-3-enyl-methyl-octadec-17-enylsilylsilane.
What is the SMILES notation for but-3-enyl-methyl-octadec-17-enylsilylsilane?
The canonical SMILES for but-3-enyl-methyl-octadec-17-enylsilylsilane is C=CCCCCCCCCCCCCCCCC[SiH2][SiH](C)CCC=C.
What is the InChIKey of but-3-enyl-methyl-octadec-17-enylsilylsilane?
The InChIKey is BAPKIVLFNVJYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H48Si2/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-25(3)23-7-5-2/h4-5,25H,1-2,6-24H2,3H3.
What are the key properties of but-3-enyl-methyl-octadec-17-enylsilylsilane?
but-3-enyl-methyl-octadec-17-enylsilylsilane has a molecular weight of 380.81 g/mol, XLogP of 7.54, 21 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-enyl-methyl-octadec-17-enylsilylsilane is sourced from PubChem (CID 173227463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).