[4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane

C26H30Si — CID 21263280

IUPAC[4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane
SMILESC=c1ccc2c(c1C1=C([Si](C)(C)C)C=C(C(C)(C)C)C1)C=c1ccccc1=2
InChIInChI=1S/C26H30Si/c1-17-12-13-21-20-11-9-8-10-18(20)14-22(21)25(17)23-15-19(26(2,3)4)16-24(23)27(5,6)7/h8-14,16H,1,15H2,2-7H3
InChIKeyRUAWAYZIZAWZML-UHFFFAOYSA-N
MW370.61 g/mol
LogP5.53
Rot. Bonds2

About [4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane

[4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane (PubChem CID 21263280) has the molecular formula C26H30Si and a molecular weight of 370.61 g/mol. Its IUPAC name is [4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane.

Molecular Properties

Compound Name[4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane
PubChem CID21263280
Molecular FormulaC26H30Si
Molecular Weight370.61 g/mol
Exact Mass370.21
IUPAC Name[4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane
SMILESC=c1ccc2c(c1C1=C([Si](C)(C)C)C=C(C(C)(C)C)C1)C=c1ccccc1=2
InChIInChI=1S/C26H30Si/c1-17-12-13-21-20-11-9-8-10-18(20)14-22(21)25(17)23-15-19(26(2,3)4)16-24(23)27(5,6)7/h8-14,16H,1,15H2,2-7H3
InChIKeyRUAWAYZIZAWZML-UHFFFAOYSA-N
XLogP5.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.61
LogP ≤ 55.53
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 [4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane?
The IUPAC name of [4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane (CID 21263280) is [4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane.
What is the SMILES notation for [4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane?
The canonical SMILES for [4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane is C=c1ccc2c(c1C1=C([Si](C)(C)C)C=C(C(C)(C)C)C1)C=c1ccccc1=2.
What is the InChIKey of [4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane?
The InChIKey is RUAWAYZIZAWZML-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30Si/c1-17-12-13-21-20-11-9-8-10-18(20)14-22(21)25(17)23-15-19(26(2,3)4)16-24(23)27(5,6)7/h8-14,16H,1,15H2,2-7H3.
What are the key properties of [4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane?
[4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane has a molecular weight of 370.61 g/mol, XLogP of 5.53, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [4-tert-butyl-2-(2-methylidenefluoren-1-yl)cyclopenta-1,4-dien-1-yl]-trimethylsilane is sourced from PubChem (CID 21263280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).