(4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane

C28H25NSi — CID 59489115

IUPAC(4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane
SMILESC=Cc1ccc([Si](C)(C)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C28H25NSi/c1-4-21-13-17-23(18-14-21)30(2,3)24-19-15-22(16-20-24)29-27-11-7-5-9-25(27)26-10-6-8-12-28(26)29/h4-20H,1H2,2-3H3
InChIKeyQPXMZFXHFZSXAX-UHFFFAOYSA-N
MW403.60 g/mol
LogP6.25
Rot. Bonds4

About (4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane

(4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane (PubChem CID 59489115) has the molecular formula C28H25NSi and a molecular weight of 403.60 g/mol. Its IUPAC name is (4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane.

Molecular Properties

Compound Name(4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane
PubChem CID59489115
Molecular FormulaC28H25NSi
Molecular Weight403.60 g/mol
Exact Mass403.18
IUPAC Name(4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane
SMILESC=Cc1ccc([Si](C)(C)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C28H25NSi/c1-4-21-13-17-23(18-14-21)30(2,3)24-19-15-22(16-20-24)29-27-11-7-5-9-25(27)26-10-6-8-12-28(26)29/h4-20H,1H2,2-3H3
InChIKeyQPXMZFXHFZSXAX-UHFFFAOYSA-N
XLogP6.25
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.60
LogP ≤ 56.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane?
The IUPAC name of (4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane (CID 59489115) is (4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane.
What is the SMILES notation for (4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane?
The canonical SMILES for (4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane is C=Cc1ccc([Si](C)(C)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.
What is the InChIKey of (4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane?
The InChIKey is QPXMZFXHFZSXAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H25NSi/c1-4-21-13-17-23(18-14-21)30(2,3)24-19-15-22(16-20-24)29-27-11-7-5-9-25(27)26-10-6-8-12-28(26)29/h4-20H,1H2,2-3H3.
What are the key properties of (4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane?
(4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane has a molecular weight of 403.60 g/mol, XLogP of 6.25, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane is sourced from PubChem (CID 59489115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).