1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride

C16H17Cl3SiTi — CID 18766762

IUPAC1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride
SMILESC[Si](C)(C)C1c2[c-]cccc2-c2ccccc21.[Cl-].[Cl-].[Cl-].[Ti+4]
InChIInChI=1S/C16H17Si.3ClH.Ti/c1-17(2,3)16-14-10-6-4-8-12(14)13-9-5-7-11-15(13)16;;;;/h4-10,16H,1-3H3;3*1H;/q-1;;;;+4/p-3
InChIKeyYRJAUEOKMMWKPZ-UHFFFAOYSA-K
MW391.62 g/mol
LogP-4.51
Rot. Bonds1

About 1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride

1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride (PubChem CID 18766762) has the molecular formula C16H17Cl3SiTi and a molecular weight of 391.62 g/mol. Its IUPAC name is 1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride.

Molecular Properties

Compound Name1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride
PubChem CID18766762
Molecular FormulaC16H17Cl3SiTi
Molecular Weight391.62 g/mol
Exact Mass389.96
IUPAC Name1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride
SMILESC[Si](C)(C)C1c2[c-]cccc2-c2ccccc21.[Cl-].[Cl-].[Cl-].[Ti+4]
InChIInChI=1S/C16H17Si.3ClH.Ti/c1-17(2,3)16-14-10-6-4-8-12(14)13-9-5-7-11-15(13)16;;;;/h4-10,16H,1-3H3;3*1H;/q-1;;;;+4/p-3
InChIKeyYRJAUEOKMMWKPZ-UHFFFAOYSA-K
XLogP-4.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.62
LogP ≤ 5-4.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride?
The IUPAC name of 1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride (CID 18766762) is 1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride.
What is the SMILES notation for 1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride?
The canonical SMILES for 1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride is C[Si](C)(C)C1c2[c-]cccc2-c2ccccc21.[Cl-].[Cl-].[Cl-].[Ti+4].
What is the InChIKey of 1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride?
The InChIKey is YRJAUEOKMMWKPZ-UHFFFAOYSA-K. The full InChI is InChI=1S/C16H17Si.3ClH.Ti/c1-17(2,3)16-14-10-6-4-8-12(14)13-9-5-7-11-15(13)16;;;;/h4-10,16H,1-3H3;3*1H;/q-1;;;;+4/p-3.
What are the key properties of 1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride?
1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride has a molecular weight of 391.62 g/mol, XLogP of -4.51, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,9-dihydrofluoren-1-id-9-yl(trimethyl)silane;titanium(4+);trichloride is sourced from PubChem (CID 18766762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).