(3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane

C26H51BSi4Sn — CID 15495133

IUPAC(3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane
SMILESCCB(CC)C1=C([Si](C)(C)C#C[Si](C)(C)C)[Si](C)(C)C2=C1C(CC)=C([Sn](C)(C)C)[Si]2(C)C
InChIInChI=1S/C23H42BSi4.3CH3.Sn/c1-13-19-18-27(9,10)22-20(19)21(24(14-2)15-3)23(28(22,11)12)26(7,8)17-16-25(4,5)6;;;;/h13-15H2,1-12H3;3*1H3;
InChIKeyRAKDLSHBUIDLSN-UHFFFAOYSA-N
MW605.56 g/mol
LogP8.51
Rot. Bonds6

About (3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane

(3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane (PubChem CID 15495133) has the molecular formula C26H51BSi4Sn and a molecular weight of 605.56 g/mol. Its IUPAC name is (3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane.

Molecular Properties

Compound Name(3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane
PubChem CID15495133
Molecular FormulaC26H51BSi4Sn
Molecular Weight605.56 g/mol
Exact Mass606.22
IUPAC Name(3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane
SMILESCCB(CC)C1=C([Si](C)(C)C#C[Si](C)(C)C)[Si](C)(C)C2=C1C(CC)=C([Sn](C)(C)C)[Si]2(C)C
InChIInChI=1S/C23H42BSi4.3CH3.Sn/c1-13-19-18-27(9,10)22-20(19)21(24(14-2)15-3)23(28(22,11)12)26(7,8)17-16-25(4,5)6;;;;/h13-15H2,1-12H3;3*1H3;
InChIKeyRAKDLSHBUIDLSN-UHFFFAOYSA-N
XLogP8.51
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 ≤ 58.51
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-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane with MolForge

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Launch Full Analysis

Related Compounds

(3-Diethylboranyl-4-ethyl-1,1-dimethyl-5-trimethylsilylstannol-2-yl)-trimethylsilane
CID 12412363
(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
[2,2-di(propan-2-yl)-3-trimethylsilyl-5,6-dihydro-4H-cyclopenta[c]silol-1-yl]-trimethylsilane
CID 10904261
(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-11-ethyl-5,5,7,7,9,9-hexamethyl-10-trimethylstannyl-5,7,9-trisilatricyclo[6.3.0.02,6]undeca-1(8),2(6),3,10-tetraen-4-yl)-trimethylsilane
CID 15495134
Trimethyl-(3,11,12-triethyl-5,5,7,7,9,9-hexamethyl-4-trimethylstannyl-5,7,9-trisila-12-boratricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,10-tetraen-10-yl)silane
CID 15495135
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
[3-Diethylboranyl-4-ethyl-5-[hex-1-ynyl(dimethyl)silyl]-1,1-dimethylstannol-2-yl]-hex-1-ynyl-dimethylsilane
CID 15495143

Frequently Asked Questions

What is the IUPAC name of (3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane?
The IUPAC name of (3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane (CID 15495133) is (3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane.
What is the SMILES notation for (3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane?
The canonical SMILES for (3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane is CCB(CC)C1=C([Si](C)(C)C#C[Si](C)(C)C)[Si](C)(C)C2=C1C(CC)=C([Sn](C)(C)C)[Si]2(C)C.
What is the InChIKey of (3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane?
The InChIKey is RAKDLSHBUIDLSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H42BSi4.3CH3.Sn/c1-13-19-18-27(9,10)22-20(19)21(24(14-2)15-3)23(28(22,11)12)26(7,8)17-16-25(4,5)6;;;;/h13-15H2,1-12H3;3*1H3;.
What are the key properties of (3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane?
(3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane has a molecular weight of 605.56 g/mol, XLogP of 8.51, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-diethylboranyl-4-ethyl-1,1,6,6-tetramethyl-5-trimethylstannylsilolo[2,3-b]silol-2-yl)-dimethyl-(2-trimethylsilylethynyl)silane is sourced from PubChem (CID 15495133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).