tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane

C30H54OSi2 — CID 139767408

IUPACtert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane
SMILESC=CCC1=C(C)CC(C[Si](C)(O[Si](C)(CC2CC(C)=C(CC=C)C2)C(C)(C)C)C(C)(C)C)C1
InChIInChI=1S/C30H54OSi2/c1-13-15-27-19-25(17-23(27)3)21-32(11,29(5,6)7)31-33(12,30(8,9)10)22-26-18-24(4)28(20-26)16-14-2/h13-14,25-26H,1-2,15-22H2,3-12H3
InChIKeyXWOBNDHSDBPGSS-UHFFFAOYSA-N
MW486.93 g/mol
LogP10.36
Rot. Bonds10

About tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane

tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane (PubChem CID 139767408) has the molecular formula C30H54OSi2 and a molecular weight of 486.93 g/mol. Its IUPAC name is tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane.

Molecular Properties

Compound Nametert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane
PubChem CID139767408
Molecular FormulaC30H54OSi2
Molecular Weight486.93 g/mol
Exact Mass486.37
IUPAC Nametert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane
SMILESC=CCC1=C(C)CC(C[Si](C)(O[Si](C)(CC2CC(C)=C(CC=C)C2)C(C)(C)C)C(C)(C)C)C1
InChIInChI=1S/C30H54OSi2/c1-13-15-27-19-25(17-23(27)3)21-32(11,29(5,6)7)31-33(12,30(8,9)10)22-26-18-24(4)28(20-26)16-14-2/h13-14,25-26H,1-2,15-22H2,3-12H3
InChIKeyXWOBNDHSDBPGSS-UHFFFAOYSA-N
XLogP10.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.93
LogP ≤ 510.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane?
The IUPAC name of tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane (CID 139767408) is tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane.
What is the SMILES notation for tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane?
The canonical SMILES for tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane is C=CCC1=C(C)CC(C[Si](C)(O[Si](C)(CC2CC(C)=C(CC=C)C2)C(C)(C)C)C(C)(C)C)C1.
What is the InChIKey of tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane?
The InChIKey is XWOBNDHSDBPGSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H54OSi2/c1-13-15-27-19-25(17-23(27)3)21-32(11,29(5,6)7)31-33(12,30(8,9)10)22-26-18-24(4)28(20-26)16-14-2/h13-14,25-26H,1-2,15-22H2,3-12H3.
What are the key properties of tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane?
tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane has a molecular weight of 486.93 g/mol, XLogP of 10.36, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[tert-butyl-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silyl]oxy-methyl-[(3-methyl-4-prop-2-enylcyclopent-3-en-1-yl)methyl]silane is sourced from PubChem (CID 139767408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).