bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate

C14H31NO5Si3 — CID 5352677

IUPACbis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate
SMILESC[Si](C)(C)O/N=C(\CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C14H31NO5Si3/c1-21(2,3)18-13(16)11-10-12(15-20-23(7,8)9)14(17)19-22(4,5)6/h10-11H2,1-9H3/b15-12+
InChIKeyBZEWGWAWDLBKEY-NTCAYCPXSA-N
MW377.66 g/mol
LogP3.73
Rot. Bonds8

About bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate

bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate (PubChem CID 5352677) has the molecular formula C14H31NO5Si3 and a molecular weight of 377.66 g/mol. Its IUPAC name is bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate
PubChem CID5352677
Molecular FormulaC14H31NO5Si3
Molecular Weight377.66 g/mol
Exact Mass377.15
IUPAC Namebis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate
SMILESC[Si](C)(C)O/N=C(\CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C14H31NO5Si3/c1-21(2,3)18-13(16)11-10-12(15-20-23(7,8)9)14(17)19-22(4,5)6/h10-11H2,1-9H3/b15-12+
InChIKeyBZEWGWAWDLBKEY-NTCAYCPXSA-N
XLogP3.73
TPSA74.19 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.66
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate
CID 528740
trimethylsilyl (2E)-2-trimethylsilyloxyiminohexanoate
CID 5463671
trimethylsilyl (7E)-7-trimethylsilyloxyiminooctanoate
CID 5372781
trimethylsilyl (2Z)-2-methoxyiminopentanoate
CID 5366686
1-O-prop-1-en-2-yl 4-O-trimethylsilyl butanedioate
CID 552478
bis(trimethylsilyl) (Z)-oct-4-enedioate
CID 91753100
trimethylsilyl 3-trimethylsilylsulfanylpropanoate
CID 637748
trimethylsilyl 4-[bis(trimethylsilyl)amino]butanoate
CID 529208
bis(trimethylsilyl) (3E,5E)-3,5-bis(ethoxyimino)octanedioate
CID 5366431
trimethylsilyl 4-oxo-5-(trimethylsilylamino)pentanoate
CID 568353
bis(trimethylsilyl) (Z)-3-trimethylsilyloxyhex-2-enedioate
CID 6421159
trimethylsilyl icosanoate
CID 521648

Frequently Asked Questions

What is the IUPAC name of bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate?
The IUPAC name of bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate (CID 5352677) is bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate.
What is the SMILES notation for bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate?
The canonical SMILES for bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate is C[Si](C)(C)O/N=C(\CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate?
The InChIKey is BZEWGWAWDLBKEY-NTCAYCPXSA-N. The full InChI is InChI=1S/C14H31NO5Si3/c1-21(2,3)18-13(16)11-10-12(15-20-23(7,8)9)14(17)19-22(4,5)6/h10-11H2,1-9H3/b15-12+.
What are the key properties of bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate?
bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate has a molecular weight of 377.66 g/mol, XLogP of 3.73, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) (2E)-2-trimethylsilyloxyiminopentanedioate is sourced from PubChem (CID 5352677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).