(5Z)-5-(trimethylsilylmethylidene)furan-2-one

C8H12O2Si — CID 101024474

IUPAC(5Z)-5-(trimethylsilylmethylidene)furan-2-one
SMILESC[Si](C)(C)/C=C1/C=CC(=O)O1
InChIInChI=1S/C8H12O2Si/c1-11(2,3)6-7-4-5-8(9)10-7/h4-6H,1-3H3/b7-6-
InChIKeyZJUSULIPDOOLEP-SREVYHEPSA-N
MW168.27 g/mol
LogP1.86
Rot. Bonds1

About (5Z)-5-(trimethylsilylmethylidene)furan-2-one

(5Z)-5-(trimethylsilylmethylidene)furan-2-one (PubChem CID 101024474) has the molecular formula C8H12O2Si and a molecular weight of 168.27 g/mol. Its IUPAC name is (5Z)-5-(trimethylsilylmethylidene)furan-2-one.

Molecular Properties

Compound Name(5Z)-5-(trimethylsilylmethylidene)furan-2-one
PubChem CID101024474
Molecular FormulaC8H12O2Si
Molecular Weight168.27 g/mol
Exact Mass168.06
IUPAC Name(5Z)-5-(trimethylsilylmethylidene)furan-2-one
SMILESC[Si](C)(C)/C=C1/C=CC(=O)O1
InChIInChI=1S/C8H12O2Si/c1-11(2,3)6-7-4-5-8(9)10-7/h4-6H,1-3H3/b7-6-
InChIKeyZJUSULIPDOOLEP-SREVYHEPSA-N
XLogP1.86
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.27
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5Z)-5-(trimethylsilylmethylidene)furan-2-one?
The IUPAC name of (5Z)-5-(trimethylsilylmethylidene)furan-2-one (CID 101024474) is (5Z)-5-(trimethylsilylmethylidene)furan-2-one.
What is the SMILES notation for (5Z)-5-(trimethylsilylmethylidene)furan-2-one?
The canonical SMILES for (5Z)-5-(trimethylsilylmethylidene)furan-2-one is C[Si](C)(C)/C=C1/C=CC(=O)O1.
What is the InChIKey of (5Z)-5-(trimethylsilylmethylidene)furan-2-one?
The InChIKey is ZJUSULIPDOOLEP-SREVYHEPSA-N. The full InChI is InChI=1S/C8H12O2Si/c1-11(2,3)6-7-4-5-8(9)10-7/h4-6H,1-3H3/b7-6-.
What are the key properties of (5Z)-5-(trimethylsilylmethylidene)furan-2-one?
(5Z)-5-(trimethylsilylmethylidene)furan-2-one has a molecular weight of 168.27 g/mol, XLogP of 1.86, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-(trimethylsilylmethylidene)furan-2-one is sourced from PubChem (CID 101024474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).