butoxy-dodecyl-dimethylsilane

C18H40OSi — CID 531758

IUPACbutoxy-dodecyl-dimethylsilane
SMILESCCCCCCCCCCCC[Si](C)(C)OCCCC
InChIInChI=1S/C18H40OSi/c1-5-7-9-10-11-12-13-14-15-16-18-20(3,4)19-17-8-6-2/h5-18H2,1-4H3
InChIKeyQOTZDUKBLYGCBT-UHFFFAOYSA-N
MW300.60 g/mol
LogP6.93
Rot. Bonds15

About butoxy-dodecyl-dimethylsilane

butoxy-dodecyl-dimethylsilane (PubChem CID 531758) has the molecular formula C18H40OSi and a molecular weight of 300.60 g/mol. Its IUPAC name is butoxy-dodecyl-dimethylsilane.

Molecular Properties

Compound Namebutoxy-dodecyl-dimethylsilane
PubChem CID531758
Molecular FormulaC18H40OSi
Molecular Weight300.60 g/mol
Exact Mass300.28
IUPAC Namebutoxy-dodecyl-dimethylsilane
SMILESCCCCCCCCCCCC[Si](C)(C)OCCCC
InChIInChI=1S/C18H40OSi/c1-5-7-9-10-11-12-13-14-15-16-18-20(3,4)19-17-8-6-2/h5-18H2,1-4H3
InChIKeyQOTZDUKBLYGCBT-UHFFFAOYSA-N
XLogP6.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.60
LogP ≤ 56.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

Octyltriethoxysilane
CID 76262
Stearoxytrimethylsilane
CID 87778
Stearyl triethoxysilane
CID 81885
Decyltriethoxysilane
CID 76261
Dodecyltriethoxysilane
CID 87696
Diethoxymethyloctadecylsilane
CID 105838
Silane, methoxydimethyloctadecyl-
CID 172903
Triethoxyhexadecylsilane
CID 85407
n-Octylmethyldiethoxysilane
CID 13222362
Silane, dimethoxymethyloctadecyl-
CID 116906
Silane, dodecyldiethoxymethyl-
CID 108922
(Hexadecyloxy)trimethylsilane
CID 22588

Frequently Asked Questions

What is the IUPAC name of butoxy-dodecyl-dimethylsilane?
The IUPAC name of butoxy-dodecyl-dimethylsilane (CID 531758) is butoxy-dodecyl-dimethylsilane.
What is the SMILES notation for butoxy-dodecyl-dimethylsilane?
The canonical SMILES for butoxy-dodecyl-dimethylsilane is CCCCCCCCCCCC[Si](C)(C)OCCCC.
What is the InChIKey of butoxy-dodecyl-dimethylsilane?
The InChIKey is QOTZDUKBLYGCBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H40OSi/c1-5-7-9-10-11-12-13-14-15-16-18-20(3,4)19-17-8-6-2/h5-18H2,1-4H3.
What are the key properties of butoxy-dodecyl-dimethylsilane?
butoxy-dodecyl-dimethylsilane has a molecular weight of 300.60 g/mol, XLogP of 6.93, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-dodecyl-dimethylsilane is sourced from PubChem (CID 531758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).