[3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane

C26H51BSi4Sn — CID 15495147

IUPAC[3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane
SMILESCCB(CC)C1=C([Si](C)(C)C#C[Si](C)(C)C)[Sn](C)(C)C([Si](C)(C)C#C[Si](C)(C)C)=C1CC
InChIInChI=1S/C24H45BSi4.2CH3.Sn/c1-14-23(21-28(10,11)19-17-26(4,5)6)24(25(15-2)16-3)22-29(12,13)20-18-27(7,8)9;;;/h14-16H2,1-13H3;2*1H3;
InChIKeyTZFXQEJCBFTJSN-UHFFFAOYSA-N
MW605.56 g/mol
LogP8.20
Rot. Bonds6

About [3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane

[3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane (PubChem CID 15495147) has the molecular formula C26H51BSi4Sn and a molecular weight of 605.56 g/mol. Its IUPAC name is [3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane.

Molecular Properties

Compound Name[3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane
PubChem CID15495147
Molecular FormulaC26H51BSi4Sn
Molecular Weight605.56 g/mol
Exact Mass606.22
IUPAC Name[3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane
SMILESCCB(CC)C1=C([Si](C)(C)C#C[Si](C)(C)C)[Sn](C)(C)C([Si](C)(C)C#C[Si](C)(C)C)=C1CC
InChIInChI=1S/C24H45BSi4.2CH3.Sn/c1-14-23(21-28(10,11)19-17-26(4,5)6)24(25(15-2)16-3)22-29(12,13)20-18-27(7,8)9;;;/h14-16H2,1-13H3;2*1H3;
InChIKeyTZFXQEJCBFTJSN-UHFFFAOYSA-N
XLogP8.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500605.56
LogP ≤ 58.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze [3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-Diethylboranyl-4-ethyl-1,1-dimethyl-5-trimethylsilylstannol-2-yl)-trimethylsilane
CID 12412363
[4-Bis(prop-2-enyl)boranyl-1,1-dimethyl-3-prop-2-enyl-5-trimethylstannylsilol-2-yl]-trimethylsilane
CID 135081386
(1,1-Dibutyl-3-diethylboranyl-4-ethyl-5-trimethylsilylstannol-2-yl)-trimethylsilane
CID 154716772
Borane, [3,8-diethyl-1,4,6,9-tetrakis(trimethylsilyl)-5-stannaspiro[4.4]nona-1,3,6,8-tetraene-2,7-diyl]bis[diethyl-
CID 625425
Ethyl-[4-ethyl-1,1-dimethyl-2,5-bis(trimethylsilyl)silol-3-yl]-dimethylsilane
CID 54397224
3-diethylboranyl-4-ethyl-1-N,1-N,1-N',1-N',2,5-hexakis(trimethylsilyl)stannole-1,1-diamine
CID 12104014
(3-Diethylboranyl-4-ethyl-1,1-dimethyl-5-trimethylsilylsilol-2-yl)-trimethylsilane
CID 15151075
Bis(3-diethylboranyl-4-ethyl-1,1-dimethyl-5-trimethylstannylsilol-2-yl)-dimethylsilane
CID 15495132
(3-Diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane
CID 15495133
Bis(4-diethylboranyl-3-ethyl-1,1-dimethylsilol-2-yl)-dimethylstannane
CID 15495136
[3-Diethylboranyl-5-[(4-diethylboranyl-3-ethyl-1,1-dimethyl-5-trimethylsilylsilol-2-yl)-dimethylstannyl]-4-ethyl-1,1-dimethylsilol-2-yl]-trimethylsilane
CID 15495141
[3-Diethylboranyl-4-ethyl-5-[ethynyl(dimethyl)silyl]-1,1-dimethylstannol-2-yl]-ethynyl-dimethylsilane
CID 15495142

Frequently Asked Questions

What is the IUPAC name of [3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane?
The IUPAC name of [3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane (CID 15495147) is [3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane.
What is the SMILES notation for [3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane?
The canonical SMILES for [3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane is CCB(CC)C1=C([Si](C)(C)C#C[Si](C)(C)C)[Sn](C)(C)C([Si](C)(C)C#C[Si](C)(C)C)=C1CC.
What is the InChIKey of [3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane?
The InChIKey is TZFXQEJCBFTJSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H45BSi4.2CH3.Sn/c1-14-23(21-28(10,11)19-17-26(4,5)6)24(25(15-2)16-3)22-29(12,13)20-18-27(7,8)9;;;/h14-16H2,1-13H3;2*1H3;.
What are the key properties of [3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane?
[3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane has a molecular weight of 605.56 g/mol, XLogP of 8.20, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [3-diethylboranyl-5-[dimethyl(2-trimethylsilylethynyl)silyl]-4-ethyl-1,1-dimethylstannol-2-yl]-dimethyl-(2-trimethylsilylethynyl)silane is sourced from PubChem (CID 15495147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).