(Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal

C11H21FO2Si — CID 139673726

IUPAC(Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal
SMILESCC(C)(C)[Si](C)(C)O/C=C\CC(F)C=O
InChIInChI=1S/C11H21FO2Si/c1-11(2,3)15(4,5)14-8-6-7-10(12)9-13/h6,8-10H,7H2,1-5H3/b8-6-
InChIKeyYOWZFOBCBHNDBZ-VURMDHGXSA-N
MW232.37 g/mol
LogP3.45
Rot. Bonds5

About (Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal

(Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal (PubChem CID 139673726) has the molecular formula C11H21FO2Si and a molecular weight of 232.37 g/mol. Its IUPAC name is (Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal.

Molecular Properties

Compound Name(Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal
PubChem CID139673726
Molecular FormulaC11H21FO2Si
Molecular Weight232.37 g/mol
Exact Mass232.13
IUPAC Name(Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal
SMILESCC(C)(C)[Si](C)(C)O/C=C\CC(F)C=O
InChIInChI=1S/C11H21FO2Si/c1-11(2,3)15(4,5)14-8-6-7-10(12)9-13/h6,8-10H,7H2,1-5H3/b8-6-
InChIKeyYOWZFOBCBHNDBZ-VURMDHGXSA-N
XLogP3.45
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal?
The IUPAC name of (Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal (CID 139673726) is (Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal.
What is the SMILES notation for (Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal?
The canonical SMILES for (Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal is CC(C)(C)[Si](C)(C)O/C=C\CC(F)C=O.
What is the InChIKey of (Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal?
The InChIKey is YOWZFOBCBHNDBZ-VURMDHGXSA-N. The full InChI is InChI=1S/C11H21FO2Si/c1-11(2,3)15(4,5)14-8-6-7-10(12)9-13/h6,8-10H,7H2,1-5H3/b8-6-.
What are the key properties of (Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal?
(Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal has a molecular weight of 232.37 g/mol, XLogP of 3.45, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-[tert-butyl(dimethyl)silyl]oxy-2-fluoropent-4-enal is sourced from PubChem (CID 139673726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).