2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+))

C160H200Cl8Si4Zr4 — CID 162276803

IUPAC2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+))
SMILESC=CCCC(C)(C)C1CC([Si](c2ccccc2)(c2ccccc2)C2C3C=C(C(C)(C)C)C=CC3C3C=CC(C(C)(C)C)=CC32)C2C=CC=CC21.C=CCCC1CC([Si](c2ccccc2)(c2ccccc2)C2C3C=CC=CC3C3C=CC=CC32)C2C=CC=CC12.C=CCCC[Si](c1ccccc1)(C1CCC2C=CC=CC21)C1C2C=CC=CC2C2C=CC=CC21.C=CCC[Si](c1ccccc1)(C1CCC2C=CC=CC21)C1C2C=CC=CC2C2C=CC=CC21.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/C49H62Si.C38H40Si.C33H38Si.C32H36Si.8CH3.8ClH.4Zr/c1-10-11-30-49(8,9)44-33-45(41-25-19-18-24-40(41)44)50(36-20-14-12-15-21-36,37-22-16-13-17-23-37)46-42-31-34(47(2,3)4)26-28-38(42)39-29-27-35(32-43(39)46)48(5,6)7;1-2-3-16-28-27-37(34-24-13-10-21-31(28)34)39(29-17-6-4-7-18-29,30-19-8-5-9-20-30)38-35-25-14-11-22-32(35)33-23-12-15-26-36(33)38;1-2-3-13-24-34(26-15-5-4-6-16-26,32-23-22-25-14-7-8-17-27(25)32)33-30-20-11-9-18-28(30)29-19-10-12-21-31(29)33;1-2-3-23-33(25-14-5-4-6-15-25,31-22-21-24-13-7-8-16-26(24)31)32-29-19-11-9-17-27(29)28-18-10-12-20-30(28)32;;;;;;;;;;;;;;;;;;;;/h10,12-29,31-32,38-46H,1,11,30,33H2,2-9H3;2,4-15,17-26,28,31-38H,1,3,16,27H2;2,4-12,14-21,25,27-33H,1,3,13,22-24H2;2,4-20,24,26-32H,1,3,21-23H2;8*1H3;8*1H;;;;/q;;;;8*-1;;;;;;;;;4*+4/p-8
InChIKeyOSWBXPZANSQIOW-UHFFFAOYSA-F
MW2884.22 g/mol
LogP44.57
Rot. Bonds28

About 2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+))

2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+)) (PubChem CID 162276803) has the molecular formula C160H200Cl8Si4Zr4 and a molecular weight of 2884.22 g/mol. Its IUPAC name is 2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+)).

Molecular Properties

Compound Name2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+))
PubChem CID162276803
Molecular FormulaC160H200Cl8Si4Zr4
Molecular Weight2884.22 g/mol
Exact Mass2872.84
IUPAC Name2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+))
SMILESC=CCCC(C)(C)C1CC([Si](c2ccccc2)(c2ccccc2)C2C3C=C(C(C)(C)C)C=CC3C3C=CC(C(C)(C)C)=CC32)C2C=CC=CC21.C=CCCC1CC([Si](c2ccccc2)(c2ccccc2)C2C3C=CC=CC3C3C=CC=CC32)C2C=CC=CC12.C=CCCC[Si](c1ccccc1)(C1CCC2C=CC=CC21)C1C2C=CC=CC2C2C=CC=CC21.C=CCC[Si](c1ccccc1)(C1CCC2C=CC=CC21)C1C2C=CC=CC2C2C=CC=CC21.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/C49H62Si.C38H40Si.C33H38Si.C32H36Si.8CH3.8ClH.4Zr/c1-10-11-30-49(8,9)44-33-45(41-25-19-18-24-40(41)44)50(36-20-14-12-15-21-36,37-22-16-13-17-23-37)46-42-31-34(47(2,3)4)26-28-38(42)39-29-27-35(32-43(39)46)48(5,6)7;1-2-3-16-28-27-37(34-24-13-10-21-31(28)34)39(29-17-6-4-7-18-29,30-19-8-5-9-20-30)38-35-25-14-11-22-32(35)33-23-12-15-26-36(33)38;1-2-3-13-24-34(26-15-5-4-6-16-26,32-23-22-25-14-7-8-17-27(25)32)33-30-20-11-9-18-28(30)29-19-10-12-21-31(29)33;1-2-3-23-33(25-14-5-4-6-15-25,31-22-21-24-13-7-8-16-26(24)31)32-29-19-11-9-17-27(29)28-18-10-12-20-30(28)32;;;;;;;;;;;;;;;;;;;;/h10,12-29,31-32,38-46H,1,11,30,33H2,2-9H3;2,4-15,17-26,28,31-38H,1,3,16,27H2;2,4-12,14-21,25,27-33H,1,3,13,22-24H2;2,4-20,24,26-32H,1,3,21-23H2;8*1H3;8*1H;;;;/q;;;;8*-1;;;;;;;;;4*+4/p-8
InChIKeyOSWBXPZANSQIOW-UHFFFAOYSA-F
XLogP44.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds28
Heavy Atoms176
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002884.22
LogP ≤ 544.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+))?
The IUPAC name of 2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+)) (CID 162276803) is 2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+)).
What is the SMILES notation for 2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+))?
The canonical SMILES for 2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+)) is C=CCCC(C)(C)C1CC([Si](c2ccccc2)(c2ccccc2)C2C3C=C(C(C)(C)C)C=CC3C3C=CC(C(C)(C)C)=CC32)C2C=CC=CC21.C=CCCC1CC([Si](c2ccccc2)(c2ccccc2)C2C3C=CC=CC3C3C=CC=CC32)C2C=CC=CC12.C=CCCC[Si](c1ccccc1)(C1CCC2C=CC=CC21)C1C2C=CC=CC2C2C=CC=CC21.C=CCC[Si](c1ccccc1)(C1CCC2C=CC=CC21)C1C2C=CC=CC2C2C=CC=CC21.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.Cl[Zr+2]Cl.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].
What is the InChIKey of 2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+))?
The InChIKey is OSWBXPZANSQIOW-UHFFFAOYSA-F. The full InChI is InChI=1S/C49H62Si.C38H40Si.C33H38Si.C32H36Si.8CH3.8ClH.4Zr/c1-10-11-30-49(8,9)44-33-45(41-25-19-18-24-40(41)44)50(36-20-14-12-15-21-36,37-22-16-13-17-23-37)46-42-31-34(47(2,3)4)26-28-38(42)39-29-27-35(32-43(39)46)48(5,6)7;1-2-3-16-28-27-37(34-24-13-10-21-31(28)34)39(29-17-6-4-7-18-29,30-19-8-5-9-20-30)38-35-25-14-11-22-32(35)33-23-12-15-26-36(33)38;1-2-3-13-24-34(26-15-5-4-6-16-26,32-23-22-25-14-7-8-17-27(25)32)33-30-20-11-9-18-28(30)29-19-10-12-21-31(29)33;1-2-3-23-33(25-14-5-4-6-15-25,31-22-21-24-13-7-8-16-26(24)31)32-29-19-11-9-17-27(29)28-18-10-12-20-30(28)32;;;;;;;;;;;;;;;;;;;;/h10,12-29,31-32,38-46H,1,11,30,33H2,2-9H3;2,4-15,17-26,28,31-38H,1,3,16,27H2;2,4-12,14-21,25,27-33H,1,3,13,22-24H2;2,4-20,24,26-32H,1,3,21-23H2;8*1H3;8*1H;;;;/q;;;;8*-1;;;;;;;;;4*+4/p-8.
What are the key properties of 2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+))?
2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+)) has a molecular weight of 2884.22 g/mol, XLogP of 44.57, 28 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-but-3-enyl-phenylsilane;2,3,3a,7a-tetrahydro-1H-inden-1-yl-(4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-pent-4-enyl-phenylsilane;4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-(3-but-3-enyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilane;carbanide;(2,7-ditert-butyl-4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl)-[3-(2-methylhex-5-en-2-yl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-diphenylsilane;tetrakis(dichlorozirconium(2+)) is sourced from PubChem (CID 162276803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).