(2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one

C21H24O3Si — CID 10991789

IUPAC(2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one
SMILESCC(C)(C)[Si](OC[C@H]1C=CC(=O)O1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H24O3Si/c1-21(2,3)25(18-10-6-4-7-11-18,19-12-8-5-9-13-19)23-16-17-14-15-20(22)24-17/h4-15,17H,16H2,1-3H3/t17-/m1/s1
InChIKeyVXTQWNKHHWYJRP-QGZVFWFLSA-N
MW352.51 g/mol
LogP3.04
Rot. Bonds5

About (2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one

(2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one (PubChem CID 10991789) has the molecular formula C21H24O3Si and a molecular weight of 352.51 g/mol. Its IUPAC name is (2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one.

Molecular Properties

Compound Name(2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one
PubChem CID10991789
Molecular FormulaC21H24O3Si
Molecular Weight352.51 g/mol
Exact Mass352.15
IUPAC Name(2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one
SMILESCC(C)(C)[Si](OC[C@H]1C=CC(=O)O1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H24O3Si/c1-21(2,3)25(18-10-6-4-7-11-18,19-12-8-5-9-13-19)23-16-17-14-15-20(22)24-17/h4-15,17H,16H2,1-3H3/t17-/m1/s1
InChIKeyVXTQWNKHHWYJRP-QGZVFWFLSA-N
XLogP3.04
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.51
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one with MolForge

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Related Compounds

2(5H)-Furanone, 5-[[[(1,1-dimethylethyl)diphenylsilyl]oxy]methyl]-, (S)-
CID 10991787
ethyl (Z)-5-[tert-butyl(diphenyl)silyl]oxy-2-fluoropent-2-enoate
CID 44134231
methyl (E)-3-[tert-butyl(diphenyl)silyl]prop-2-enoate
CID 10358911
methyl (2E,5S,6R,7E)-5-[tert-butyl(diphenyl)silyl]oxy-6-methylnona-2,7-dienoate
CID 10765397
(2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2,3-dihydropyran-6-one
CID 10883073
ethyl (Z,4R)-6-[tert-butyl(diphenyl)silyl]oxy-2-ethyl-4-methylhex-2-enoate
CID 11166530
ethyl (E)-4-triphenylsilylbut-2-enoate
CID 11349290
methyl (E,4R)-5-[tert-butyl(diphenyl)silyl]oxy-2,4-dimethylpent-2-enoate
CID 102512030
3-O-allyl-1,4-anhydro-5-O-t-butyldiphenylsilyl-2-deoxy-d-erythro-pent-1-enitol
CID 129709571
Ethyl (2S)-2-[[(1,1-dimethylethyl)diphenylsilyl]oxy]propanoate
CID 11210501
ethyl (E,4S)-4-[tert-butyl(diphenyl)silyl]oxypent-2-enoate
CID 11417698
methyl (E)-5-[tert-butyl(diphenyl)silyl]oxypent-2-enoate
CID 11726542

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one?
The IUPAC name of (2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one (CID 10991789) is (2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one.
What is the SMILES notation for (2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one?
The canonical SMILES for (2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one is CC(C)(C)[Si](OC[C@H]1C=CC(=O)O1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one?
The InChIKey is VXTQWNKHHWYJRP-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H24O3Si/c1-21(2,3)25(18-10-6-4-7-11-18,19-12-8-5-9-13-19)23-16-17-14-15-20(22)24-17/h4-15,17H,16H2,1-3H3/t17-/m1/s1.
What are the key properties of (2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one?
(2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one has a molecular weight of 352.51 g/mol, XLogP of 3.04, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-2H-furan-5-one is sourced from PubChem (CID 10991789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).