bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate

C15H33NO5Si3 — CID 528740

IUPACbis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate
SMILESC[Si](C)(C)ON=C(CCCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C15H33NO5Si3/c1-22(2,3)19-14(17)12-10-11-13(16-21-24(7,8)9)15(18)20-23(4,5)6/h10-12H2,1-9H3
InChIKeyHUDNSTCQNYJCQY-UHFFFAOYSA-N
MW391.69 g/mol
LogP4.12
Rot. Bonds9

About bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate

bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate (PubChem CID 528740) has the molecular formula C15H33NO5Si3 and a molecular weight of 391.69 g/mol. Its IUPAC name is bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate
PubChem CID528740
Molecular FormulaC15H33NO5Si3
Molecular Weight391.69 g/mol
Exact Mass391.17
IUPAC Namebis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate
SMILESC[Si](C)(C)ON=C(CCCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C15H33NO5Si3/c1-22(2,3)19-14(17)12-10-11-13(16-21-24(7,8)9)15(18)20-23(4,5)6/h10-12H2,1-9H3
InChIKeyHUDNSTCQNYJCQY-UHFFFAOYSA-N
XLogP4.12
TPSA74.19 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.69
LogP ≤ 54.12
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) (2E)-2-trimethylsilyloxyiminopentanedioate
CID 5352677
trimethylsilyl (2E)-2-trimethylsilyloxyiminohexanoate
CID 5463671
trimethylsilyl (7E)-7-trimethylsilyloxyiminooctanoate
CID 5372781
trimethylsilyl (2Z)-2-methoxyiminopentanoate
CID 5366686
trimethylsilyl 4-[bis(trimethylsilyl)amino]butanoate
CID 529208
trimethylsilyl icosanoate
CID 521648
trimethylsilyl 6-[bis(trimethylsilyl)amino]hexanoate
CID 529226
(E)-2-methyl-3-(4-oxo-4-trimethylsilyloxybutyl)but-2-enedioic acid
CID 151184176
bis(trimethylsilyl) (Z)-oct-4-enedioate
CID 91753100
trimethylsilyl 3-trimethylsilylsulfanylpropanoate
CID 637748
trimethylsilyl 17-methyloctadecanoate
CID 91752780
trimethylsilyl 2-phenylmethoxyiminooctanoate
CID 561576

Frequently Asked Questions

What is the IUPAC name of bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate?
The IUPAC name of bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate (CID 528740) is bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate.
What is the SMILES notation for bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate?
The canonical SMILES for bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate is C[Si](C)(C)ON=C(CCCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate?
The InChIKey is HUDNSTCQNYJCQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO5Si3/c1-22(2,3)19-14(17)12-10-11-13(16-21-24(7,8)9)15(18)20-23(4,5)6/h10-12H2,1-9H3.
What are the key properties of bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate?
bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate has a molecular weight of 391.69 g/mol, XLogP of 4.12, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) 2-trimethylsilyloxyiminohexanedioate is sourced from PubChem (CID 528740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).