tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane

C16H30OSSi — CID 66709489

IUPACtert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane
SMILESCC(C)(C)[Si](C)(C)OCCCCCCc1ccsc1
InChIInChI=1S/C16H30OSSi/c1-16(2,3)19(4,5)17-12-9-7-6-8-10-15-11-13-18-14-15/h11,13-14H,6-10,12H2,1-5H3
InChIKeyZEEDXBJARGREIE-UHFFFAOYSA-N
MW298.57 g/mol
LogP5.87
Rot. Bonds8

About tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane

tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane (PubChem CID 66709489) has the molecular formula C16H30OSSi and a molecular weight of 298.57 g/mol. Its IUPAC name is tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane
PubChem CID66709489
Molecular FormulaC16H30OSSi
Molecular Weight298.57 g/mol
Exact Mass298.18
IUPAC Nametert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane
SMILESCC(C)(C)[Si](C)(C)OCCCCCCc1ccsc1
InChIInChI=1S/C16H30OSSi/c1-16(2,3)19(4,5)17-12-9-7-6-8-10-15-11-13-18-14-15/h11,13-14H,6-10,12H2,1-5H3
InChIKeyZEEDXBJARGREIE-UHFFFAOYSA-N
XLogP5.87
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.57
LogP ≤ 55.87
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'}

Analyze tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane?
The IUPAC name of tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane (CID 66709489) is tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane is CC(C)(C)[Si](C)(C)OCCCCCCc1ccsc1.
What is the InChIKey of tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane?
The InChIKey is ZEEDXBJARGREIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30OSSi/c1-16(2,3)19(4,5)17-12-9-7-6-8-10-15-11-13-18-14-15/h11,13-14H,6-10,12H2,1-5H3.
What are the key properties of tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane?
tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane has a molecular weight of 298.57 g/mol, XLogP of 5.87, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(6-thiophen-3-ylhexoxy)silane is sourced from PubChem (CID 66709489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).