[4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane

C20H26Si — CID 123942923

IUPAC[4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane
SMILESCc1ccc(-c2ccc(C3CCC(C[SiH3])CC3)cc2)cc1
InChIInChI=1S/C20H26Si/c1-15-2-6-17(7-3-15)19-10-12-20(13-11-19)18-8-4-16(14-21)5-9-18/h2-3,6-7,10-13,16,18H,4-5,8-9,14H2,1,21H3
InChIKeyGVTBAKQLKOYVTH-UHFFFAOYSA-N
MW294.51 g/mol
LogP4.72
Rot. Bonds3

About [4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane

[4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane (PubChem CID 123942923) has the molecular formula C20H26Si and a molecular weight of 294.51 g/mol. Its IUPAC name is [4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane.

Molecular Properties

Compound Name[4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane
PubChem CID123942923
Molecular FormulaC20H26Si
Molecular Weight294.51 g/mol
Exact Mass294.18
IUPAC Name[4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane
SMILESCc1ccc(-c2ccc(C3CCC(C[SiH3])CC3)cc2)cc1
InChIInChI=1S/C20H26Si/c1-15-2-6-17(7-3-15)19-10-12-20(13-11-19)18-8-4-16(14-21)5-9-18/h2-3,6-7,10-13,16,18H,4-5,8-9,14H2,1,21H3
InChIKeyGVTBAKQLKOYVTH-UHFFFAOYSA-N
XLogP4.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.51
LogP ≤ 54.72
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-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane?
The IUPAC name of [4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane (CID 123942923) is [4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane.
What is the SMILES notation for [4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane?
The canonical SMILES for [4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane is Cc1ccc(-c2ccc(C3CCC(C[SiH3])CC3)cc2)cc1.
What is the InChIKey of [4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane?
The InChIKey is GVTBAKQLKOYVTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26Si/c1-15-2-6-17(7-3-15)19-10-12-20(13-11-19)18-8-4-16(14-21)5-9-18/h2-3,6-7,10-13,16,18H,4-5,8-9,14H2,1,21H3.
What are the key properties of [4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane?
[4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane has a molecular weight of 294.51 g/mol, XLogP of 4.72, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-(4-methylphenyl)phenyl]cyclohexyl]methylsilane is sourced from PubChem (CID 123942923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).