chloro-tri(nonyl)silane

C27H57ClSi — CID 140826961

IUPACchloro-tri(nonyl)silane
SMILESCCCCCCCCC[Si](Cl)(CCCCCCCCC)CCCCCCCCC
InChIInChI=1S/C27H57ClSi/c1-4-7-10-13-16-19-22-25-29(28,26-23-20-17-14-11-8-5-2)27-24-21-18-15-12-9-6-3/h4-27H2,1-3H3
InChIKeyLSGBTNKDGIPTST-UHFFFAOYSA-N
MW445.29 g/mol
LogP11.42
Rot. Bonds24

About chloro-tri(nonyl)silane

chloro-tri(nonyl)silane (PubChem CID 140826961) has the molecular formula C27H57ClSi and a molecular weight of 445.29 g/mol. Its IUPAC name is chloro-tri(nonyl)silane.

Molecular Properties

Compound Namechloro-tri(nonyl)silane
PubChem CID140826961
Molecular FormulaC27H57ClSi
Molecular Weight445.29 g/mol
Exact Mass444.39
IUPAC Namechloro-tri(nonyl)silane
SMILESCCCCCCCCC[Si](Cl)(CCCCCCCCC)CCCCCCCCC
InChIInChI=1S/C27H57ClSi/c1-4-7-10-13-16-19-22-25-29(28,26-23-20-17-14-11-8-5-2)27-24-21-18-15-12-9-6-3/h4-27H2,1-3H3
InChIKeyLSGBTNKDGIPTST-UHFFFAOYSA-N
XLogP11.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds24
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500445.29
LogP ≤ 511.42
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': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane
CID 87144873
trichloro(octyl)silane
CID 21354
butyl-dichloro-octylsilane
CID 140745133
chloro-dimethyl-nonadecylsilane
CID 87338427
dichloro-[6-[dichloro-[6-[dichloro-[6-[dichloro-[6-[dichloro(heptyl)silyl]hexyl]silyl]hexyl]silyl]hexyl]silyl]hexyl]-propylsilane
CID 59426953
dichloro-iodo-octylsilane
CID 154486818
chlorosilane;trichloro(tetradecyl)silane
CID 159383155
dichloro-(2-methylpropyl)-octadecylsilane
CID 141127282
bromo-chloro-hexyl-methylsilane
CID 140744885
butyl-chloro-methyl-pentylsilane
CID 87411075
trichloro(3-chloropropyl)silane;trichloro(octyl)silane
CID 87989801
butyl-[2-(butyl-chloro-decylsilyl)ethynyl]-chloro-decylsilane
CID 139634038

Frequently Asked Questions

What is the IUPAC name of chloro-tri(nonyl)silane?
The IUPAC name of chloro-tri(nonyl)silane (CID 140826961) is chloro-tri(nonyl)silane.
What is the SMILES notation for chloro-tri(nonyl)silane?
The canonical SMILES for chloro-tri(nonyl)silane is CCCCCCCCC[Si](Cl)(CCCCCCCCC)CCCCCCCCC.
What is the InChIKey of chloro-tri(nonyl)silane?
The InChIKey is LSGBTNKDGIPTST-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H57ClSi/c1-4-7-10-13-16-19-22-25-29(28,26-23-20-17-14-11-8-5-2)27-24-21-18-15-12-9-6-3/h4-27H2,1-3H3.
What are the key properties of chloro-tri(nonyl)silane?
chloro-tri(nonyl)silane has a molecular weight of 445.29 g/mol, XLogP of 11.42, 24 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-tri(nonyl)silane is sourced from PubChem (CID 140826961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).