3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane

C38H70O5Si4 — CID 57226450

About 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane

3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane (PubChem CID 57226450) has the molecular formula C38H70O5Si4 and a molecular weight of 719.32 g/mol. Its IUPAC name is 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane.

Molecular Properties

• Compound Name: 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane
• PubChem CID: 57226450
• Molecular Formula: C38H70O5Si4
• Molecular Weight: 719.32 g/mol
• Exact Mass: 718.43
• IUPAC Name: 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane
• SMILES: COCOC1(CC#C[Si](C)(C)C)C=CC(CC(C)(C)[Si](C)(C)O[Si](C)(C)C(C)(C)CC2C=CC(CC#C[Si](C)(C)C)(OCOC)C2)C1
• InChI: InChI=1S/C38H70O5Si4/c1-35(2,27-33-19-23-37(29-33,41-31-39-5)21-17-25-44(7,8)9)46(13,14)43-47(15,16)36(3,4)28-34-20-24-38(30-34,42-32-40-6)22-18-26-45(10,11)12/h19-20,23-24,33-34H,21-22,27-32H2,1-16H3
• InChIKey: YTXCSOAKXQCSLA-UHFFFAOYSA-N
• XLogP: 10.17
• TPSA: 46.15 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 16
• Heavy Atoms: 47
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	719.32
LogP ≤ 5	10.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane?

The IUPAC name of 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane (CID 57226450) is 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane.

What is the SMILES notation for 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane?

The canonical SMILES for 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane is COCOC1(CC#C[Si](C)(C)C)C=CC(CC(C)(C)[Si](C)(C)O[Si](C)(C)C(C)(C)CC2C=CC(CC#C[Si](C)(C)C)(OCOC)C2)C1.

What is the InChIKey of 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane?

The InChIKey is YTXCSOAKXQCSLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H70O5Si4/c1-35(2,27-33-19-23-37(29-33,41-31-39-5)21-17-25-44(7,8)9)46(13,14)43-47(15,16)36(3,4)28-34-20-24-38(30-34,42-32-40-6)22-18-26-45(10,11)12/h19-20,23-24,33-34H,21-22,27-32H2,1-16H3.

What are the key properties of 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane?

3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane has a molecular weight of 719.32 g/mol, XLogP of 10.17, 16 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[1-(methoxymethoxy)-4-[2-[[[1-[4-(methoxymethoxy)-4-(3-trimethylsilylprop-2-ynyl)cyclopent-2-en-1-yl]-2-methylpropan-2-yl]-dimethylsilyl]oxy-dimethylsilyl]-2-methylpropyl]cyclopent-2-en-1-yl]prop-1-ynyl-trimethylsilane is sourced from PubChem (CID 57226450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).