dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane

C15H22Si — CID 11128130

IUPACdimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane
SMILESC[C@H]1CC=C[C@H]([Si](C)(C)c2ccccc2)C1
InChIInChI=1S/C15H22Si/c1-13-8-7-11-15(12-13)16(2,3)14-9-5-4-6-10-14/h4-7,9-11,13,15H,8,12H2,1-3H3/t13-,15-/m0/s1
InChIKeyZRYAJQIYXWIPCI-ZFWWWQNUSA-N
MW230.43 g/mol
LogP3.96
Rot. Bonds2

About dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane

dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane (PubChem CID 11128130) has the molecular formula C15H22Si and a molecular weight of 230.43 g/mol. Its IUPAC name is dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane.

Molecular Properties

Compound Namedimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane
PubChem CID11128130
Molecular FormulaC15H22Si
Molecular Weight230.43 g/mol
Exact Mass230.15
IUPAC Namedimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane
SMILESC[C@H]1CC=C[C@H]([Si](C)(C)c2ccccc2)C1
InChIInChI=1S/C15H22Si/c1-13-8-7-11-15(12-13)16(2,3)14-9-5-4-6-10-14/h4-7,9-11,13,15H,8,12H2,1-3H3/t13-,15-/m0/s1
InChIKeyZRYAJQIYXWIPCI-ZFWWWQNUSA-N
XLogP3.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.43
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane?
The IUPAC name of dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane (CID 11128130) is dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane.
What is the SMILES notation for dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane?
The canonical SMILES for dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane is C[C@H]1CC=C[C@H]([Si](C)(C)c2ccccc2)C1.
What is the InChIKey of dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane?
The InChIKey is ZRYAJQIYXWIPCI-ZFWWWQNUSA-N. The full InChI is InChI=1S/C15H22Si/c1-13-8-7-11-15(12-13)16(2,3)14-9-5-4-6-10-14/h4-7,9-11,13,15H,8,12H2,1-3H3/t13-,15-/m0/s1.
What are the key properties of dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane?
dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane has a molecular weight of 230.43 g/mol, XLogP of 3.96, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[(1R,5S)-5-methylcyclohex-2-en-1-yl]-phenylsilane is sourced from PubChem (CID 11128130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).