heptadecyl(dioctyl)silane

C33H70Si — CID 173389450

IUPACheptadecyl(dioctyl)silane
SMILESCCCCCCCCCCCCCCCCC[SiH](CCCCCCCC)CCCCCCCC
InChIInChI=1S/C33H70Si/c1-4-7-10-13-16-17-18-19-20-21-22-23-24-27-30-33-34(31-28-25-14-11-8-5-2)32-29-26-15-12-9-6-3/h34H,4-33H2,1-3H3
InChIKeyUBNYZVJWALWKPC-UHFFFAOYSA-N
MW495.01 g/mol
LogP12.81
Rot. Bonds30

About heptadecyl(dioctyl)silane

heptadecyl(dioctyl)silane (PubChem CID 173389450) has the molecular formula C33H70Si and a molecular weight of 495.01 g/mol. Its IUPAC name is heptadecyl(dioctyl)silane.

Molecular Properties

Compound Nameheptadecyl(dioctyl)silane
PubChem CID173389450
Molecular FormulaC33H70Si
Molecular Weight495.01 g/mol
Exact Mass494.52
IUPAC Nameheptadecyl(dioctyl)silane
SMILESCCCCCCCCCCCCCCCCC[SiH](CCCCCCCC)CCCCCCCC
InChIInChI=1S/C33H70Si/c1-4-7-10-13-16-17-18-19-20-21-22-23-24-27-30-33-34(31-28-25-14-11-8-5-2)32-29-26-15-12-9-6-3/h34H,4-33H2,1-3H3
InChIKeyUBNYZVJWALWKPC-UHFFFAOYSA-N
XLogP12.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds30
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500495.01
LogP ≤ 512.81
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'}

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Related Compounds

dibutyl(hexyl)silane
CID 123774823
hydron;trihexylsilane
CID 175247078
butyl-di(nonyl)silane
CID 174773592
butyl-[[heptyl(hexyl)silyl]methyl]-pentylsilane
CID 59923839
methyl-di(tetradecyl)silane
CID 175036176
didecyl(methyl)silane
CID 71366123
dimethyl(nonyl)silane
CID 71400453
dihexyl(prop-2-enyl)silane
CID 175543178
CID 161246447
CID 161246447
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
hexacosane;octacosane
CID 158944700

Frequently Asked Questions

What is the IUPAC name of heptadecyl(dioctyl)silane?
The IUPAC name of heptadecyl(dioctyl)silane (CID 173389450) is heptadecyl(dioctyl)silane.
What is the SMILES notation for heptadecyl(dioctyl)silane?
The canonical SMILES for heptadecyl(dioctyl)silane is CCCCCCCCCCCCCCCCC[SiH](CCCCCCCC)CCCCCCCC.
What is the InChIKey of heptadecyl(dioctyl)silane?
The InChIKey is UBNYZVJWALWKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H70Si/c1-4-7-10-13-16-17-18-19-20-21-22-23-24-27-30-33-34(31-28-25-14-11-8-5-2)32-29-26-15-12-9-6-3/h34H,4-33H2,1-3H3.
What are the key properties of heptadecyl(dioctyl)silane?
heptadecyl(dioctyl)silane has a molecular weight of 495.01 g/mol, XLogP of 12.81, 30 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for heptadecyl(dioctyl)silane is sourced from PubChem (CID 173389450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).