6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate

C18H32O4Si2 — CID 57060135

IUPAC6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate
SMILESC[Si](C)(C)OC1C=C(C=CCCCCOC(=O)[Si](C)(C)C)C(=O)C1
InChIInChI=1S/C18H32O4Si2/c1-23(2,3)18(20)21-12-10-8-7-9-11-15-13-16(14-17(15)19)22-24(4,5)6/h9,11,13,16H,7-8,10,12,14H2,1-6H3
InChIKeyUROZJVSDYMXUPL-UHFFFAOYSA-N
MW368.62 g/mol
LogP4.89
Rot. Bonds9

About 6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate

6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate (PubChem CID 57060135) has the molecular formula C18H32O4Si2 and a molecular weight of 368.62 g/mol. Its IUPAC name is 6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate.

Molecular Properties

Compound Name6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate
PubChem CID57060135
Molecular FormulaC18H32O4Si2
Molecular Weight368.62 g/mol
Exact Mass368.18
IUPAC Name6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate
SMILESC[Si](C)(C)OC1C=C(C=CCCCCOC(=O)[Si](C)(C)C)C(=O)C1
InChIInChI=1S/C18H32O4Si2/c1-23(2,3)18(20)21-12-10-8-7-9-11-15-13-16(14-17(15)19)22-24(4,5)6/h9,11,13,16H,7-8,10,12,14H2,1-6H3
InChIKeyUROZJVSDYMXUPL-UHFFFAOYSA-N
XLogP4.89
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.62
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

CID 91697008
CID 91697008
CID 57327645
CID 57327645
CID 5366811
CID 5366811
CID 5378947
CID 5378947
CID 91697027
CID 91697027
CID 91741858
CID 91741858
CID 91742468
CID 91742468
CID 10981066
CID 10981066
CID 11057306
CID 11057306
CID 12770874
CID 12770874
CID 13427683
CID 13427683
CID 13427731
CID 13427731

Frequently Asked Questions

What is the IUPAC name of 6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate?
The IUPAC name of 6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate (CID 57060135) is 6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate.
What is the SMILES notation for 6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate?
The canonical SMILES for 6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate is C[Si](C)(C)OC1C=C(C=CCCCCOC(=O)[Si](C)(C)C)C(=O)C1.
What is the InChIKey of 6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate?
The InChIKey is UROZJVSDYMXUPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32O4Si2/c1-23(2,3)18(20)21-12-10-8-7-9-11-15-13-16(14-17(15)19)22-24(4,5)6/h9,11,13,16H,7-8,10,12,14H2,1-6H3.
What are the key properties of 6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate?
6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate has a molecular weight of 368.62 g/mol, XLogP of 4.89, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-oxo-3-trimethylsilyloxycyclopenten-1-yl)hex-5-enyl trimethylsilylformate is sourced from PubChem (CID 57060135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).