2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole

C19H21FOSi2 — CID 177461672

IUPAC2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole
SMILESCOc1ccc2c(c1)[Si](C)(C)C1=C2[Si](C)(C)c2cc(F)ccc21
InChIInChI=1S/C19H21FOSi2/c1-21-13-7-9-15-17(11-13)23(4,5)18-14-8-6-12(20)10-16(14)22(2,3)19(15)18/h6-11H,1-5H3
InChIKeyYIYZROPJJZIYGE-UHFFFAOYSA-N
MW340.55 g/mol
LogP3.68
Rot. Bonds1

About 2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole

2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole (PubChem CID 177461672) has the molecular formula C19H21FOSi2 and a molecular weight of 340.55 g/mol. Its IUPAC name is 2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole.

Molecular Properties

Compound Name2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole
PubChem CID177461672
Molecular FormulaC19H21FOSi2
Molecular Weight340.55 g/mol
Exact Mass340.11
IUPAC Name2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole
SMILESCOc1ccc2c(c1)[Si](C)(C)C1=C2[Si](C)(C)c2cc(F)ccc21
InChIInChI=1S/C19H21FOSi2/c1-21-13-7-9-15-17(11-13)23(4,5)18-14-8-6-12(20)10-16(14)22(2,3)19(15)18/h6-11H,1-5H3
InChIKeyYIYZROPJJZIYGE-UHFFFAOYSA-N
XLogP3.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.55
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole?
The IUPAC name of 2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole (CID 177461672) is 2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole.
What is the SMILES notation for 2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole?
The canonical SMILES for 2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole is COc1ccc2c(c1)[Si](C)(C)C1=C2[Si](C)(C)c2cc(F)ccc21.
What is the InChIKey of 2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole?
The InChIKey is YIYZROPJJZIYGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FOSi2/c1-21-13-7-9-15-17(11-13)23(4,5)18-14-8-6-12(20)10-16(14)22(2,3)19(15)18/h6-11H,1-5H3.
What are the key properties of 2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole?
2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole has a molecular weight of 340.55 g/mol, XLogP of 3.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-7-methoxy-5,5,10,10-tetramethyl-[1]benzosilolo[3,2-b][1]benzosilole is sourced from PubChem (CID 177461672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).