(2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane

C23H26Br2Si2 — CID 67039516

IUPAC(2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane
SMILESC[Si](C)(C)C1=CCC([Si](C)(C)C2c3cc(Br)ccc3-c3ccc(Br)cc32)=C1
InChIInChI=1S/C23H26Br2Si2/c1-26(2,3)17-8-9-18(14-17)27(4,5)23-21-12-15(24)6-10-19(21)20-11-7-16(25)13-22(20)23/h6-8,10-14,23H,9H2,1-5H3
InChIKeyBQENLAPXKQHAKV-UHFFFAOYSA-N
MW518.44 g/mol
LogP8.24
Rot. Bonds3

About (2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane

(2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane (PubChem CID 67039516) has the molecular formula C23H26Br2Si2 and a molecular weight of 518.44 g/mol. Its IUPAC name is (2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane.

Molecular Properties

Compound Name(2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane
PubChem CID67039516
Molecular FormulaC23H26Br2Si2
Molecular Weight518.44 g/mol
Exact Mass515.99
IUPAC Name(2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane
SMILESC[Si](C)(C)C1=CCC([Si](C)(C)C2c3cc(Br)ccc3-c3ccc(Br)cc32)=C1
InChIInChI=1S/C23H26Br2Si2/c1-26(2,3)17-8-9-18(14-17)27(4,5)23-21-12-15(24)6-10-19(21)20-11-7-16(25)13-22(20)23/h6-8,10-14,23H,9H2,1-5H3
InChIKeyBQENLAPXKQHAKV-UHFFFAOYSA-N
XLogP8.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500518.44
LogP ≤ 58.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 (2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane?
The IUPAC name of (2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane (CID 67039516) is (2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane.
What is the SMILES notation for (2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane?
The canonical SMILES for (2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane is C[Si](C)(C)C1=CCC([Si](C)(C)C2c3cc(Br)ccc3-c3ccc(Br)cc32)=C1.
What is the InChIKey of (2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane?
The InChIKey is BQENLAPXKQHAKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26Br2Si2/c1-26(2,3)17-8-9-18(14-17)27(4,5)23-21-12-15(24)6-10-19(21)20-11-7-16(25)13-22(20)23/h6-8,10-14,23H,9H2,1-5H3.
What are the key properties of (2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane?
(2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane has a molecular weight of 518.44 g/mol, XLogP of 8.24, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2,7-dibromo-9H-fluoren-9-yl)-dimethyl-(3-trimethylsilylcyclopenta-1,3-dien-1-yl)silane is sourced from PubChem (CID 67039516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).