[2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane

C22H33BO2Si — CID 11485466

IUPAC[2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane
SMILESCC1(C)OB(C(=C=C2CCCCC2)[Si](C)(C)c2ccccc2)OC1(C)C
InChIInChI=1S/C22H33BO2Si/c1-21(2)22(3,4)25-23(24-21)20(17-18-13-9-7-10-14-18)26(5,6)19-15-11-8-12-16-19/h8,11-12,15-16H,7,9-10,13-14H2,1-6H3
InChIKeyVFGDLDWZUZNWJD-UHFFFAOYSA-N
MW368.40 g/mol
LogP5.19
Rot. Bonds3

About [2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane

[2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane (PubChem CID 11485466) has the molecular formula C22H33BO2Si and a molecular weight of 368.40 g/mol. Its IUPAC name is [2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane.

Molecular Properties

Compound Name[2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane
PubChem CID11485466
Molecular FormulaC22H33BO2Si
Molecular Weight368.40 g/mol
Exact Mass368.23
IUPAC Name[2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane
SMILESCC1(C)OB(C(=C=C2CCCCC2)[Si](C)(C)c2ccccc2)OC1(C)C
InChIInChI=1S/C22H33BO2Si/c1-21(2)22(3,4)25-23(24-21)20(17-18-13-9-7-10-14-18)26(5,6)19-15-11-8-12-16-19/h8,11-12,15-16H,7,9-10,13-14H2,1-6H3
InChIKeyVFGDLDWZUZNWJD-UHFFFAOYSA-N
XLogP5.19
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.40
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

dimethyl-phenyl-[2-[1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]cyclohexyl]silane
CID 134904088
dimethyl-phenyl-[(1Z,3E)-1,2,3,4-tetraphenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)buta-1,3-dienyl]silane
CID 135061365
[1-cyclopropylidene-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propyl]-dimethyl-phenylsilane
CID 11198651
1-cyclohexylideneprop-1-en-2-ylbenzene
CID 10081457
[3-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-2-enyl]-triphenylsilane
CID 139833210
[2,4-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-3-en-2-yl]-dimethyl-phenylsilane
CID 100945364
dimethyl-phenyl-[3-[1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]cyclohexyl]silane
CID 134904089
4,4,5,5-tetramethyl-2-[(Z)-1-phenylprop-1-enyl]-1,3,2-dioxaborolane
CID 15748693
4,4,5,5-tetramethyl-2-[(E)-3-phenylbut-2-en-2-yl]-1,3,2-dioxaborolane
CID 11196194
diphenyl-bis[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)oxy]silane
CID 11048939
dimethyl-phenyl-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-en-3-yl]silane
CID 135049091
[2-(1-cyclopentylideneprop-1-en-2-yl)cyclohexen-1-yl]benzene
CID 102158684

Frequently Asked Questions

What is the IUPAC name of [2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane?
The IUPAC name of [2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane (CID 11485466) is [2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane.
What is the SMILES notation for [2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane?
The canonical SMILES for [2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane is CC1(C)OB(C(=C=C2CCCCC2)[Si](C)(C)c2ccccc2)OC1(C)C.
What is the InChIKey of [2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane?
The InChIKey is VFGDLDWZUZNWJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H33BO2Si/c1-21(2)22(3,4)25-23(24-21)20(17-18-13-9-7-10-14-18)26(5,6)19-15-11-8-12-16-19/h8,11-12,15-16H,7,9-10,13-14H2,1-6H3.
What are the key properties of [2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane?
[2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane has a molecular weight of 368.40 g/mol, XLogP of 5.19, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclohexylidene-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-dimethyl-phenylsilane is sourced from PubChem (CID 11485466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).