3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane

C18H42O4Si2 — CID 141219255

IUPAC3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane
SMILESCCCCC[Si](OC)(OC)C(C)C(C)[Si](CCCCC)(OC)OC
InChIInChI=1S/C18H42O4Si2/c1-9-11-13-15-23(19-5,20-6)17(3)18(4)24(21-7,22-8)16-14-12-10-2/h17-18H,9-16H2,1-8H3
InChIKeyGCWMSJDMEGXCNR-UHFFFAOYSA-N
MW378.70 g/mol
LogP5.62
Rot. Bonds15

About 3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane

3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane (PubChem CID 141219255) has the molecular formula C18H42O4Si2 and a molecular weight of 378.70 g/mol. Its IUPAC name is 3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane.

Molecular Properties

Compound Name3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane
PubChem CID141219255
Molecular FormulaC18H42O4Si2
Molecular Weight378.70 g/mol
Exact Mass378.26
IUPAC Name3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane
SMILESCCCCC[Si](OC)(OC)C(C)C(C)[Si](CCCCC)(OC)OC
InChIInChI=1S/C18H42O4Si2/c1-9-11-13-15-23(19-5,20-6)17(3)18(4)24(21-7,22-8)16-14-12-10-2/h17-18H,9-16H2,1-8H3
InChIKeyGCWMSJDMEGXCNR-UHFFFAOYSA-N
XLogP5.62
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.70
LogP ≤ 55.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

hexane;bis(hexyl(trimethoxy)silane)
CID 175053771
azane;trimethoxy(pentyl)silane
CID 19608931
trimethoxy(pentacontyl)silane
CID 87930715
hexacosyl(trimethoxy)silane
CID 150262252
dodecyl(trimethoxy)silane;octane
CID 174570785
decyl(trimethoxy)silane;hexyl(trimethoxy)silane
CID 22665206
hexyl-dimethoxy-nonadecylsilane
CID 139614220
dimethoxy-octyl-pentylsilane
CID 139614094
dimethoxy-nonadecyl-nonylsilane
CID 139614040
trimethoxy(undecyl)silane;hydrobromide
CID 172731268
dodecyl(trimethoxy)silane;λ2-plumbane
CID 175120013
dimethoxy-nonadecyl-pentadecylsilane
CID 139614324

Frequently Asked Questions

What is the IUPAC name of 3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane?
The IUPAC name of 3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane (CID 141219255) is 3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane.
What is the SMILES notation for 3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane?
The canonical SMILES for 3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane is CCCCC[Si](OC)(OC)C(C)C(C)[Si](CCCCC)(OC)OC.
What is the InChIKey of 3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane?
The InChIKey is GCWMSJDMEGXCNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H42O4Si2/c1-9-11-13-15-23(19-5,20-6)17(3)18(4)24(21-7,22-8)16-14-12-10-2/h17-18H,9-16H2,1-8H3.
What are the key properties of 3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane?
3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane has a molecular weight of 378.70 g/mol, XLogP of 5.62, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethoxy(pentyl)silyl]butan-2-yl-dimethoxy-pentylsilane is sourced from PubChem (CID 141219255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).