trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane

C20H38OSi2 — CID 10937036

About trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane

trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane (PubChem CID 10937036) has the molecular formula C20H38OSi2 and a molecular weight of 350.70 g/mol. Its IUPAC name is trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane.

Molecular Properties

• Compound Name: trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane
• PubChem CID: 10937036
• Molecular Formula: C20H38OSi2
• Molecular Weight: 350.70 g/mol
• Exact Mass: 350.25
• IUPAC Name: trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane
• SMILES: C=C(C[C@@H]1C[C@@H](C(=C)C)CC(O[Si](C)(C)C)=C1C)C[Si](C)(C)C
• InChI: InChI=1S/C20H38OSi2/c1-15(2)18-12-19(11-16(3)14-22(5,6)7)17(4)20(13-18)21-23(8,9)10/h18-19H,1,3,11-14H2,2,4-10H3/t18-,19-/m1/s1
• InChIKey: LWLDJMFCVPHQFQ-RTBURBONSA-N
• XLogP: 7.00
• TPSA: 9.23 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 7
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	350.70
LogP ≤ 5	7.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane?

The IUPAC name of trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane (CID 10937036) is trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane.

What is the SMILES notation for trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane?

The canonical SMILES for trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane is C=C(C[C@@H]1C[C@@H](C(=C)C)CC(O[Si](C)(C)C)=C1C)C[Si](C)(C)C.

What is the InChIKey of trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane?

The InChIKey is LWLDJMFCVPHQFQ-RTBURBONSA-N. The full InChI is InChI=1S/C20H38OSi2/c1-15(2)18-12-19(11-16(3)14-22(5,6)7)17(4)20(13-18)21-23(8,9)10/h18-19H,1,3,11-14H2,2,4-10H3/t18-,19-/m1/s1.

What are the key properties of trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane?

trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane has a molecular weight of 350.70 g/mol, XLogP of 7.00, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for trimethyl-[(3S,5R)-2-methyl-5-prop-1-en-2-yl-3-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexen-1-yl]oxysilane is sourced from PubChem (CID 10937036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).