hexyl-dimethoxy-undecylsilane

C19H42O2Si — CID 139614316

IUPAChexyl-dimethoxy-undecylsilane
SMILESCCCCCCCCCCC[Si](CCCCCC)(OC)OC
InChIInChI=1S/C19H42O2Si/c1-5-7-9-11-12-13-14-15-17-19-22(20-3,21-4)18-16-10-8-6-2/h5-19H2,1-4H3
InChIKeyPWMRPRKPQBJXRK-UHFFFAOYSA-N
MW330.63 g/mol
LogP6.83
Rot. Bonds17

About hexyl-dimethoxy-undecylsilane

hexyl-dimethoxy-undecylsilane (PubChem CID 139614316) has the molecular formula C19H42O2Si and a molecular weight of 330.63 g/mol. Its IUPAC name is hexyl-dimethoxy-undecylsilane.

Molecular Properties

Compound Namehexyl-dimethoxy-undecylsilane
PubChem CID139614316
Molecular FormulaC19H42O2Si
Molecular Weight330.63 g/mol
Exact Mass330.30
IUPAC Namehexyl-dimethoxy-undecylsilane
SMILESCCCCCCCCCCC[Si](CCCCCC)(OC)OC
InChIInChI=1S/C19H42O2Si/c1-5-7-9-11-12-13-14-15-17-19-22(20-3,21-4)18-16-10-8-6-2/h5-19H2,1-4H3
InChIKeyPWMRPRKPQBJXRK-UHFFFAOYSA-N
XLogP6.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds17
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.63
LogP ≤ 56.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

dimethoxy-nonadecyl-nonylsilane
CID 139614040
dimethoxy-octyl-pentylsilane
CID 139614094
hexyl-dimethoxy-nonadecylsilane
CID 139614220
dimethoxy-pentadecyl-undecylsilane
CID 139614261
dimethoxy-nonyl-tridecylsilane
CID 139614257
dimethoxy-nonadecyl-pentadecylsilane
CID 139614324
heptyl-dimethoxy-undecylsilane
CID 139614038
hexadecyl-icosyl-dimethoxysilane
CID 139614225
butyl-decyl-dimethoxysilane
CID 141135588
butyl-dimethoxy-tetradecylsilane
CID 139614249
8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane
CID 87498284
decyl-dimethoxy-(trimethoxysilylmethyl)silane
CID 90416169

Frequently Asked Questions

What is the IUPAC name of hexyl-dimethoxy-undecylsilane?
The IUPAC name of hexyl-dimethoxy-undecylsilane (CID 139614316) is hexyl-dimethoxy-undecylsilane.
What is the SMILES notation for hexyl-dimethoxy-undecylsilane?
The canonical SMILES for hexyl-dimethoxy-undecylsilane is CCCCCCCCCCC[Si](CCCCCC)(OC)OC.
What is the InChIKey of hexyl-dimethoxy-undecylsilane?
The InChIKey is PWMRPRKPQBJXRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H42O2Si/c1-5-7-9-11-12-13-14-15-17-19-22(20-3,21-4)18-16-10-8-6-2/h5-19H2,1-4H3.
What are the key properties of hexyl-dimethoxy-undecylsilane?
hexyl-dimethoxy-undecylsilane has a molecular weight of 330.63 g/mol, XLogP of 6.83, 17 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hexyl-dimethoxy-undecylsilane is sourced from PubChem (CID 139614316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).