tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+)

C27H70N3OSi6U — CID 135046790

IUPACtris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+)
SMILESCCCCC#CC(C)(C)O.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[U+3]
InChIInChI=1S/C9H16O.3C6H18NSi2.U/c1-4-5-6-7-8-9(2,3)10;3*1-8(2,3)7-9(4,5)6;/h10H,4-6H2,1-3H3;3*1-6H3;/q;3*-1;+3
InChIKeyMJXHNLRQSDHAHR-UHFFFAOYSA-N
MW859.42 g/mol
LogP11.04
Rot. Bonds8

About tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+)

tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+) (PubChem CID 135046790) has the molecular formula C27H70N3OSi6U and a molecular weight of 859.42 g/mol. Its IUPAC name is tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+).

Molecular Properties

Compound Nametris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+)
PubChem CID135046790
Molecular FormulaC27H70N3OSi6U
Molecular Weight859.42 g/mol
Exact Mass858.46
IUPAC Nametris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+)
SMILESCCCCC#CC(C)(C)O.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[U+3]
InChIInChI=1S/C9H16O.3C6H18NSi2.U/c1-4-5-6-7-8-9(2,3)10;3*1-8(2,3)7-9(4,5)6;/h10H,4-6H2,1-3H3;3*1-6H3;/q;3*-1;+3
InChIKeyMJXHNLRQSDHAHR-UHFFFAOYSA-N
XLogP11.04
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500859.42
LogP ≤ 511.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Tris(bis(trimethylsilyl)azanide);2-methylhept-3-yn-2-ol;uranium(3+)
CID 51003844
Tris(bis(trimethylsilyl)azanide);2,5,5-trimethylhex-3-yn-2-ol;uranium(3+)
CID 135046794
Tris(bis(trimethylsilyl)azanide);2-methylnon-3-yn-2-ol;uranium(3+)
CID 135046795
Tris(bis(trimethylsilyl)azanide);2-methyldec-3-yn-2-ol;uranium(3+)
CID 135046797
Tris(bis(trimethylsilyl)azanide);2-methylhept-3-yn-2-ol;uranium
CID 10919957

Frequently Asked Questions

What is the IUPAC name of tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+)?
The IUPAC name of tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+) (CID 135046790) is tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+).
What is the SMILES notation for tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+)?
The canonical SMILES for tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+) is CCCCC#CC(C)(C)O.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[U+3].
What is the InChIKey of tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+)?
The InChIKey is MJXHNLRQSDHAHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O.3C6H18NSi2.U/c1-4-5-6-7-8-9(2,3)10;3*1-8(2,3)7-9(4,5)6;/h10H,4-6H2,1-3H3;3*1-6H3;/q;3*-1;+3.
What are the key properties of tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+)?
tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+) has a molecular weight of 859.42 g/mol, XLogP of 11.04, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tris(bis(trimethylsilyl)azanide);2-methyloct-3-yn-2-ol;uranium(3+) is sourced from PubChem (CID 135046790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).