[(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate

C18H32O4Si2 — CID 70573057

IUPAC[(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate
SMILESC[Si](C)(C)O[C@H]1C=C(C/C=C\CCCOC(=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/h7,9,13,16H,8,10-12,14H2,1-6H3/b9-7-/t16-/m0/s1
InChIKeyAQZFIGYTUYKFAM-GQSKFBFOSA-N
MW368.62 g/mol
LogP4.89
Rot. Bonds9

About [(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate

[(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate (PubChem CID 70573057) has the molecular formula C18H32O4Si2 and a molecular weight of 368.62 g/mol. Its IUPAC name is [(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate.

Molecular Properties

Compound Name[(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate
PubChem CID70573057
Molecular FormulaC18H32O4Si2
Molecular Weight368.62 g/mol
Exact Mass368.18
IUPAC Name[(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate
SMILESC[Si](C)(C)O[C@H]1C=C(C/C=C\CCCOC(=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/h7,9,13,16H,8,10-12,14H2,1-6H3/b9-7-/t16-/m0/s1
InChIKeyAQZFIGYTUYKFAM-GQSKFBFOSA-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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze [(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate with MolForge

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Related Compounds

[(Z)-6-[(3R)-3-[tert-butyl(dimethyl)silyl]oxy-5-oxocyclopenten-1-yl]hex-4-enyl] [tert-butyl(dimethyl)silyl]formate
CID 70589487
methyl 7-(5-oxo-3-triethylsilyloxycyclopenten-1-yl)hept-5-enoate
CID 70700519
ethyl (Z)-7-(3-hydroxy-5-oxocyclopenten-1-yl)hept-5-enoate
CID 134863248
ethyl 7-[3-(oxan-2-yloxy)-5-oxocyclopenten-1-yl]hept-5-enoate
CID 54371984
[(1R)-4-oxo-3-prop-2-enylcyclopent-2-en-1-yl] acetate
CID 139646465
oxan-2-yl (Z)-7-[(3R)-3-(oxan-2-yloxy)-5-oxocyclopenten-1-yl]hept-5-enoate
CID 70618138
(4R)-4-methyl-2-[(Z)-7-oxonon-2-enyl]cyclopent-2-en-1-one
CID 118357261
butyl 7-[(3R)-3-[tert-butyl(dimethyl)silyl]oxy-5-oxocyclopenten-1-yl]heptanoate
CID 11133051
[4-(carbamoylamino)phenyl] 7-(3-hydroxy-5-oxocyclopenten-1-yl)hept-5-enoate
CID 57289547
[(Z)-7-[(3R)-3-acetyloxy-5-oxocyclopenten-1-yl]-6-bromohept-5-enyl] acetate
CID 170317056
[7-(3-acetyloxy-5-oxocyclopenten-1-yl)-6-bromohept-5-enyl] acetate
CID 170317059
4-hydroxy-2-[6-[2-(hydroxymethyl)-1,3-dioxolan-2-yl]hex-2-enyl]cyclopent-2-en-1-one
CID 57011139

Frequently Asked Questions

What is the IUPAC name of [(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate?
The IUPAC name of [(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate (CID 70573057) is [(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate.
What is the SMILES notation for [(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate?
The canonical SMILES for [(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate is C[Si](C)(C)O[C@H]1C=C(C/C=C\CCCOC(=O)[Si](C)(C)C)C(=O)C1.
What is the InChIKey of [(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate?
The InChIKey is AQZFIGYTUYKFAM-GQSKFBFOSA-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/h7,9,13,16H,8,10-12,14H2,1-6H3/b9-7-/t16-/m0/s1.
What are the key properties of [(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate?
[(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-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 [(Z)-6-[(3R)-5-oxo-3-trimethylsilyloxycyclopenten-1-yl]hex-4-enyl] trimethylsilylformate is sourced from PubChem (CID 70573057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).