dipropoxy(dithiophen-2-yl)silane

C14H20O2S2Si — CID 139618620

IUPACdipropoxy(dithiophen-2-yl)silane
SMILESCCCO[Si](OCCC)(c1cccs1)c1cccs1
InChIInChI=1S/C14H20O2S2Si/c1-3-9-15-19(16-10-4-2,13-7-5-11-17-13)14-8-6-12-18-14/h5-8,11-12H,3-4,9-10H2,1-2H3
InChIKeyLXAARKMTAOHPGN-UHFFFAOYSA-N
MW312.53 g/mol
LogP3.22
Rot. Bonds8

About dipropoxy(dithiophen-2-yl)silane

dipropoxy(dithiophen-2-yl)silane (PubChem CID 139618620) has the molecular formula C14H20O2S2Si and a molecular weight of 312.53 g/mol. Its IUPAC name is dipropoxy(dithiophen-2-yl)silane.

Molecular Properties

Compound Namedipropoxy(dithiophen-2-yl)silane
PubChem CID139618620
Molecular FormulaC14H20O2S2Si
Molecular Weight312.53 g/mol
Exact Mass312.07
IUPAC Namedipropoxy(dithiophen-2-yl)silane
SMILESCCCO[Si](OCCC)(c1cccs1)c1cccs1
InChIInChI=1S/C14H20O2S2Si/c1-3-9-15-19(16-10-4-2,13-7-5-11-17-13)14-8-6-12-18-14/h5-8,11-12H,3-4,9-10H2,1-2H3
InChIKeyLXAARKMTAOHPGN-UHFFFAOYSA-N
XLogP3.22
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.53
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dipropoxy(dithiophen-2-yl)silane?
The IUPAC name of dipropoxy(dithiophen-2-yl)silane (CID 139618620) is dipropoxy(dithiophen-2-yl)silane.
What is the SMILES notation for dipropoxy(dithiophen-2-yl)silane?
The canonical SMILES for dipropoxy(dithiophen-2-yl)silane is CCCO[Si](OCCC)(c1cccs1)c1cccs1.
What is the InChIKey of dipropoxy(dithiophen-2-yl)silane?
The InChIKey is LXAARKMTAOHPGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2S2Si/c1-3-9-15-19(16-10-4-2,13-7-5-11-17-13)14-8-6-12-18-14/h5-8,11-12H,3-4,9-10H2,1-2H3.
What are the key properties of dipropoxy(dithiophen-2-yl)silane?
dipropoxy(dithiophen-2-yl)silane has a molecular weight of 312.53 g/mol, XLogP of 3.22, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dipropoxy(dithiophen-2-yl)silane is sourced from PubChem (CID 139618620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).