5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde

C11H18O2Si — CID 15037036

IUPAC5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde
SMILESCC(C)(C)[Si](C)(C)c1cc(C=O)co1
InChIInChI=1S/C11H18O2Si/c1-11(2,3)14(4,5)10-6-9(7-12)8-13-10/h6-8H,1-5H3
InChIKeyAZTMOPQTEYFAKZ-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.81
Rot. Bonds2

About 5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde

5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde (PubChem CID 15037036) has the molecular formula C11H18O2Si and a molecular weight of 210.35 g/mol. Its IUPAC name is 5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde.

Molecular Properties

Compound Name5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde
PubChem CID15037036
Molecular FormulaC11H18O2Si
Molecular Weight210.35 g/mol
Exact Mass210.11
IUPAC Name5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde
SMILESCC(C)(C)[Si](C)(C)c1cc(C=O)co1
InChIInChI=1S/C11H18O2Si/c1-11(2,3)14(4,5)10-6-9(7-12)8-13-10/h6-8H,1-5H3
InChIKeyAZTMOPQTEYFAKZ-UHFFFAOYSA-N
XLogP2.81
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde?
The IUPAC name of 5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde (CID 15037036) is 5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde.
What is the SMILES notation for 5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde?
The canonical SMILES for 5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde is CC(C)(C)[Si](C)(C)c1cc(C=O)co1.
What is the InChIKey of 5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde?
The InChIKey is AZTMOPQTEYFAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2Si/c1-11(2,3)14(4,5)10-6-9(7-12)8-13-10/h6-8H,1-5H3.
What are the key properties of 5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde?
5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde has a molecular weight of 210.35 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[tert-butyl(dimethyl)silyl]furan-3-carbaldehyde is sourced from PubChem (CID 15037036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).