4-silyl-2H-furan-5-one

C4H6O2Si — CID 123695029

IUPAC4-silyl-2H-furan-5-one
SMILESO=C1OCC=C1[SiH3]
InChIInChI=1S/C4H6O2Si/c5-4-3(7)1-2-6-4/h1H,2H2,7H3
InChIKeyWHQMNCFMQKHZHH-UHFFFAOYSA-N
MW114.18 g/mol
LogP-1.21
Rot. Bonds

About 4-silyl-2H-furan-5-one

4-silyl-2H-furan-5-one (PubChem CID 123695029) has the molecular formula C4H6O2Si and a molecular weight of 114.18 g/mol. Its IUPAC name is 4-silyl-2H-furan-5-one.

Molecular Properties

Compound Name4-silyl-2H-furan-5-one
PubChem CID123695029
Molecular FormulaC4H6O2Si
Molecular Weight114.18 g/mol
Exact Mass114.01
IUPAC Name4-silyl-2H-furan-5-one
SMILESO=C1OCC=C1[SiH3]
InChIInChI=1S/C4H6O2Si/c5-4-3(7)1-2-6-4/h1H,2H2,7H3
InChIKeyWHQMNCFMQKHZHH-UHFFFAOYSA-N
XLogP-1.21
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.18
LogP ≤ 5-1.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-trimethylsilyl-2H-furan-5-one
CID 11506491
3-Trimethoxysilylfuran-2,5-dione
CID 58870491
3-Silylfuran-2,5-dione
CID 123405552
3-Silylpropyl but-2-enoate
CID 123816160
3-silylpropyl (E)-but-2-enoate
CID 151875201
2-Silylethyl but-2-enoate
CID 154326244
Ethenylsilane;furan-2,5-dione
CID 160806423
Furan-2,5-dione;silane
CID 161880347
methyl (E)-4-oxo-4-silylbut-2-enoate
CID 173512014
3-Aminosilylfuran-2,5-dione
CID 173512117
dimethyl (Z)-2-silylbut-2-enedioate
CID 174657385
dimethyl (E)-2-silylbut-2-enedioate
CID 174668812

Frequently Asked Questions

What is the IUPAC name of 4-silyl-2H-furan-5-one?
The IUPAC name of 4-silyl-2H-furan-5-one (CID 123695029) is 4-silyl-2H-furan-5-one.
What is the SMILES notation for 4-silyl-2H-furan-5-one?
The canonical SMILES for 4-silyl-2H-furan-5-one is O=C1OCC=C1[SiH3].
What is the InChIKey of 4-silyl-2H-furan-5-one?
The InChIKey is WHQMNCFMQKHZHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6O2Si/c5-4-3(7)1-2-6-4/h1H,2H2,7H3.
What are the key properties of 4-silyl-2H-furan-5-one?
4-silyl-2H-furan-5-one has a molecular weight of 114.18 g/mol, XLogP of -1.21, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-silyl-2H-furan-5-one is sourced from PubChem (CID 123695029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).