diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate

C14H30O6Si2 — CID 11450967

IUPACdiethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate
SMILESCCOC(=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(=O)OCC
InChIInChI=1S/C14H30O6Si2/c1-9-17-13(15)11(19-21(3,4)5)12(14(16)18-10-2)20-22(6,7)8/h11-12H,9-10H2,1-8H3/t11-,12-/m1/s1
InChIKeyDCMXSULPIKSNKM-VXGBXAGGSA-N
MW350.56 g/mol
LogP2.55
Rot. Bonds9

About diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate

diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate (PubChem CID 11450967) has the molecular formula C14H30O6Si2 and a molecular weight of 350.56 g/mol. Its IUPAC name is diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate.

Molecular Properties

Compound Namediethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate
PubChem CID11450967
Molecular FormulaC14H30O6Si2
Molecular Weight350.56 g/mol
Exact Mass350.16
IUPAC Namediethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate
SMILESCCOC(=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(=O)OCC
InChIInChI=1S/C14H30O6Si2/c1-9-17-13(15)11(19-21(3,4)5)12(14(16)18-10-2)20-22(6,7)8/h11-12H,9-10H2,1-8H3/t11-,12-/m1/s1
InChIKeyDCMXSULPIKSNKM-VXGBXAGGSA-N
XLogP2.55
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.56
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

Succinic acid, 2,3-diethoxy-, diethyl ester
CID 96236
2-Ethoxy-succinic acid diethyl ester
CID 10889368
Threono-1,4-lactone, bis-TMS
CID 523398
(3R,4R)-3,4-bis(trimethylsilyloxy)oxolan-2-one
CID 6427168
Dimethyl 2-[(trimethylsilyl)oxy]succinate
CID 552624
Butanedioic acid, 2,3-dimethoxy-, diethyl ester
CID 575878
methyl (2S,3R)-3-[[tert-butyl(dimethyl)silyl]oxymethyl]oxirane-2-carboxylate
CID 10105987
dipropan-2-yl (2S,3S)-2,3-bis[[tert-butyl(dimethyl)silyl]oxy]butanedioate
CID 11762344
Dimethyl (2R,3R)-2,3-bis{[tert-butyl(dimethyl)silyl]oxy}butanedioate
CID 15098268
Diethyl 2-(acetyloxy)butanedioate
CID 71401904
Dipropan-2-yl 2-propan-2-yloxybutanedioate
CID 86017423
Bis(2,2,2-trifluoroethyl) 2,3-bis(trimethylsilyloxy)butanedioate
CID 88550840

Frequently Asked Questions

What is the IUPAC name of diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate?
The IUPAC name of diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate (CID 11450967) is diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate.
What is the SMILES notation for diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate?
The canonical SMILES for diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate is CCOC(=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)C(=O)OCC.
What is the InChIKey of diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate?
The InChIKey is DCMXSULPIKSNKM-VXGBXAGGSA-N. The full InChI is InChI=1S/C14H30O6Si2/c1-9-17-13(15)11(19-21(3,4)5)12(14(16)18-10-2)20-22(6,7)8/h11-12H,9-10H2,1-8H3/t11-,12-/m1/s1.
What are the key properties of diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate?
diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate has a molecular weight of 350.56 g/mol, XLogP of 2.55, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl (2R,3R)-2,3-bis(trimethylsilyloxy)butanedioate is sourced from PubChem (CID 11450967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).