butyl-heptyl-methyl-octylsilane

C20H44Si — CID 168803305

IUPACbutyl-heptyl-methyl-octylsilane
SMILESCCCCCCCC[Si](C)(CCCC)CCCCCCC
InChIInChI=1S/C20H44Si/c1-5-8-11-13-15-17-20-21(4,18-10-7-3)19-16-14-12-9-6-2/h5-20H2,1-4H3
InChIKeyJCWUMXIRDMKSKS-UHFFFAOYSA-N
MW312.66 g/mol
LogP8.20
Rot. Bonds16

About butyl-heptyl-methyl-octylsilane

butyl-heptyl-methyl-octylsilane (PubChem CID 168803305) has the molecular formula C20H44Si and a molecular weight of 312.66 g/mol. Its IUPAC name is butyl-heptyl-methyl-octylsilane.

Molecular Properties

Compound Namebutyl-heptyl-methyl-octylsilane
PubChem CID168803305
Molecular FormulaC20H44Si
Molecular Weight312.66 g/mol
Exact Mass312.32
IUPAC Namebutyl-heptyl-methyl-octylsilane
SMILESCCCCCCCC[Si](C)(CCCC)CCCCCCC
InChIInChI=1S/C20H44Si/c1-5-8-11-13-15-17-20-21(4,18-10-7-3)19-16-14-12-9-6-2/h5-20H2,1-4H3
InChIKeyJCWUMXIRDMKSKS-UHFFFAOYSA-N
XLogP8.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.66
LogP ≤ 58.20
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-heptyl-methylsilane
CID 168803311
decyl-hexadecyl-methyl-octylsilane
CID 14474508
6-[dihexyl(methyl)silyl]hexan-1-amine
CID 132992433
11-bromoundecyl-dibutyl-methylsilane
CID 162391784
butyl-dimethyl-undecylsilane
CID 54018421
butyl-dihexyl-octylsilane
CID 168803297
didecyl-methyl-oct-6-enylsilane
CID 54351323
trifluoro(tridecyl)silane
CID 537319
trifluoro(hexadecyl)silane
CID 141473475
butyl-hexyl-diiodosilane
CID 140745011
ethyl-heptyl-dimethylsilane
CID 90701403
butyl-chloro-methyl-pentylsilane
CID 87411075

Frequently Asked Questions

What is the IUPAC name of butyl-heptyl-methyl-octylsilane?
The IUPAC name of butyl-heptyl-methyl-octylsilane (CID 168803305) is butyl-heptyl-methyl-octylsilane.
What is the SMILES notation for butyl-heptyl-methyl-octylsilane?
The canonical SMILES for butyl-heptyl-methyl-octylsilane is CCCCCCCC[Si](C)(CCCC)CCCCCCC.
What is the InChIKey of butyl-heptyl-methyl-octylsilane?
The InChIKey is JCWUMXIRDMKSKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H44Si/c1-5-8-11-13-15-17-20-21(4,18-10-7-3)19-16-14-12-9-6-2/h5-20H2,1-4H3.
What are the key properties of butyl-heptyl-methyl-octylsilane?
butyl-heptyl-methyl-octylsilane has a molecular weight of 312.66 g/mol, XLogP of 8.20, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-heptyl-methyl-octylsilane is sourced from PubChem (CID 168803305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).