trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane

C34H62Si7 — CID 100947594

IUPACtrimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane
SMILESCC[Si]1(CC)C#CC2=C([Si](C)(C)C)[Si](C)(C)C([Si](C)(C)C)=C2C#C[Si](CC)(CC)C([Si](C)(C)C)=C=C=C1[Si](C)(C)C
InChIInChI=1S/C34H62Si7/c1-19-40(20-2)27-25-29-30(34(38(14,15)16)39(17,18)33(29)37(11,12)13)26-28-41(21-3,22-4)32(36(8,9)10)24-23-31(40)35(5,6)7/h19-22H2,1-18H3/b32-31-
InChIKeySBHNQBWKVHOCMN-MVJHLKBCSA-N
MW667.47 g/mol
LogP10.65
Rot. Bonds8

About trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane

trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane (PubChem CID 100947594) has the molecular formula C34H62Si7 and a molecular weight of 667.47 g/mol. Its IUPAC name is trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane.

Molecular Properties

Compound Nametrimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane
PubChem CID100947594
Molecular FormulaC34H62Si7
Molecular Weight667.47 g/mol
Exact Mass666.32
IUPAC Nametrimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane
SMILESCC[Si]1(CC)C#CC2=C([Si](C)(C)C)[Si](C)(C)C([Si](C)(C)C)=C2C#C[Si](CC)(CC)C([Si](C)(C)C)=C=C=C1[Si](C)(C)C
InChIInChI=1S/C34H62Si7/c1-19-40(20-2)27-25-29-30(34(38(14,15)16)39(17,18)33(29)37(11,12)13)26-28-41(21-3,22-4)32(36(8,9)10)24-23-31(40)35(5,6)7/h19-22H2,1-18H3/b32-31-
InChIKeySBHNQBWKVHOCMN-MVJHLKBCSA-N
XLogP10.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500667.47
LogP ≤ 510.65
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 trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane with MolForge

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Related Compounds

[3,4-Dimethylidene-6-tri(propan-2-yl)silylhexa-1,5-diynyl]-tri(propan-2-yl)silane
CID 10835624
Tri(propan-2-yl)-[3,5,10,12-tetratert-butyl-14-tri(propan-2-yl)silyltetradeca-3,4,10,11-tetraen-1,6,8,13-tetraynyl]silane
CID 101212827
trimethyl-[(3Z,4Z)-6-trimethylsilyl-3,4-bis(trimethylsilylmethylidene)hexa-1,5-diynyl]silane
CID 11429239
[3,5,8,10,15,17,20,22-Octatert-butyl-24-tri(propan-2-yl)silyltetracosa-3,4,8,9,15,16,20,21-octaen-1,6,11,13,18,23-hexaynyl]-tri(propan-2-yl)silane
CID 12167049
1,1-Dimethyl-2,5-bis(trimethylsilyl)-3,4-diethynyl-1-sila-2,4-cyclopentadiene
CID 102064386
Ethyl-[[1-ethyl-3,4-dimethyl-2,5-bis(trimethylsilyl)silol-1-yl]methyl]-dimethylsilane
CID 54060859
(1,1-Diethyl-3,4-dimethyl-5-trimethylsilylsilol-2-yl)-trimethylsilane
CID 54445215
[4,4,9,9,14,14-Hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane
CID 10930123
Trimethyl-(4,4,5,5-tetraethyl-10,10-dimethyl-11-trimethylsilyl-4,5,10-trisilabicyclo[6.3.0]undeca-1(11),8-dien-2,6-diyn-9-yl)silane
CID 10950823
(4,4,5,5,10,10-Hexamethyl-11-trimethylsilyl-4,5,10-trisilabicyclo[6.3.0]undeca-1(11),8-dien-2,6-diyn-9-yl)-trimethylsilane
CID 11048006
[(1E,3Z)-3,4-bis(trimethylsilyl)-2-(2-trimethylsilylethynyl)buta-1,3-dienyl]-trimethylsilane
CID 11187732
[3,6-Bis(trimethylsilyl)-2-(2-trimethylsilylethynyl)hexa-1,3,4,5-tetraenyl]-trimethylsilane
CID 11828192

Frequently Asked Questions

What is the IUPAC name of trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane?
The IUPAC name of trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane (CID 100947594) is trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane.
What is the SMILES notation for trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane?
The canonical SMILES for trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane is CC[Si]1(CC)C#CC2=C([Si](C)(C)C)[Si](C)(C)C([Si](C)(C)C)=C2C#C[Si](CC)(CC)C([Si](C)(C)C)=C=C=C1[Si](C)(C)C.
What is the InChIKey of trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane?
The InChIKey is SBHNQBWKVHOCMN-MVJHLKBCSA-N. The full InChI is InChI=1S/C34H62Si7/c1-19-40(20-2)27-25-29-30(34(38(14,15)16)39(17,18)33(29)37(11,12)13)26-28-41(21-3,22-4)32(36(8,9)10)24-23-31(40)35(5,6)7/h19-22H2,1-18H3/b32-31-.
What are the key properties of trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane?
trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane has a molecular weight of 667.47 g/mol, XLogP of 10.65, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4,4,9,9-tetraethyl-14,14-dimethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]silane is sourced from PubChem (CID 100947594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).