[3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane

C22H30OSi2 — CID 11349127

IUPAC[3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane
SMILESC[Si](C)(OC1=CC([Si](C)(C)c2ccccc2)CCC1)c1ccccc1
InChIInChI=1S/C22H30OSi2/c1-24(2,20-13-7-5-8-14-20)22-17-11-12-19(18-22)23-25(3,4)21-15-9-6-10-16-21/h5-10,13-16,18,22H,11-12,17H2,1-4H3
InChIKeyAGLBTUBJBTULQP-UHFFFAOYSA-N
MW366.65 g/mol
LogP5.17
Rot. Bonds5

About [3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane

[3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane (PubChem CID 11349127) has the molecular formula C22H30OSi2 and a molecular weight of 366.65 g/mol. Its IUPAC name is [3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane.

Molecular Properties

Compound Name[3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane
PubChem CID11349127
Molecular FormulaC22H30OSi2
Molecular Weight366.65 g/mol
Exact Mass366.18
IUPAC Name[3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane
SMILESC[Si](C)(OC1=CC([Si](C)(C)c2ccccc2)CCC1)c1ccccc1
InChIInChI=1S/C22H30OSi2/c1-24(2,20-13-7-5-8-14-20)22-17-11-12-19(18-22)23-25(3,4)21-15-9-6-10-16-21/h5-10,13-16,18,22H,11-12,17H2,1-4H3
InChIKeyAGLBTUBJBTULQP-UHFFFAOYSA-N
XLogP5.17
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.65
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

dimethyl-(3-methylcyclohex-2-en-1-yl)-phenylsilane
CID 10421400
dimethyl-(4-methylcyclohexen-1-yl)oxy-phenylsilane
CID 102374851
(1,1-dimethyl-5-phenyl-2,5-dihydrosilol-3-yl)oxy-dimethyl-phenylsilane
CID 135062019
cyclopentyl-dimethyl-phenylsilane
CID 59962320
trimethyl-[(1R)-3-phenylcyclohex-2-en-1-yl]silane
CID 99771377
dimethyl-(2-methylidenecyclohexyl)-phenylsilane
CID 13299161
cis-(1R,2S)-2-[dimethyl(phenyl)silyl]oxycyclopentan-1-ol
CID 10633593
dimethyl-[(1S,2R)-2-methylcyclohexyl]-phenylsilane
CID 11117937
[2-(chloromethyl)-3-methylcyclohex-2-en-1-yl]-dimethyl-phenylsilane
CID 11033214
trimethyl-[3-(3-trimethylsilyloxycyclohex-2-en-1-yl)propyl]silane
CID 15505011
[(2S,3S)-3-[dimethyl(phenyl)silyl]oxiran-2-yl]-dimethyl-phenylsilane
CID 15526879
cyclopentyl-methyl-diphenylsilane
CID 123376620

Frequently Asked Questions

What is the IUPAC name of [3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane?
The IUPAC name of [3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane (CID 11349127) is [3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane.
What is the SMILES notation for [3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane?
The canonical SMILES for [3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane is C[Si](C)(OC1=CC([Si](C)(C)c2ccccc2)CCC1)c1ccccc1.
What is the InChIKey of [3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane?
The InChIKey is AGLBTUBJBTULQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30OSi2/c1-24(2,20-13-7-5-8-14-20)22-17-11-12-19(18-22)23-25(3,4)21-15-9-6-10-16-21/h5-10,13-16,18,22H,11-12,17H2,1-4H3.
What are the key properties of [3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane?
[3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane has a molecular weight of 366.65 g/mol, XLogP of 5.17, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[dimethyl(phenyl)silyl]cyclohexen-1-yl]oxy-dimethyl-phenylsilane is sourced from PubChem (CID 11349127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).