dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane

C82H68Si2 — CID 161108029

IUPACdimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane
SMILESCC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Si](C)(C)C1C(C)=Cc2c(-c3cccc4ccccc34)cccc21.C[Si](C)(C1C=Cc2c(-c3cccc4ccccc34)cccc21)C1C=Cc2c(-c3cccc4ccccc34)cccc21
InChIInChI=1S/C42H36Si.C40H32Si/c1-27-25-39-35(33-19-9-15-29-13-5-7-17-31(29)33)21-11-23-37(39)41(27)43(3,4)42-28(2)26-40-36(22-12-24-38(40)42)34-20-10-16-30-14-6-8-18-32(30)34;1-41(2,39-25-23-35-33(19-9-21-37(35)39)31-17-7-13-27-11-3-5-15-29(27)31)40-26-24-36-34(20-10-22-38(36)40)32-18-8-14-28-12-4-6-16-30(28)32/h5-26,41-42H,1-4H3;3-26,39-40H,1-2H3
InChIKeyUJHXNJAXVQLXPY-UHFFFAOYSA-N
MW1109.62 g/mol
LogP22.85
Rot. Bonds8

About dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane

dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane (PubChem CID 161108029) has the molecular formula C82H68Si2 and a molecular weight of 1109.62 g/mol. Its IUPAC name is dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane.

Molecular Properties

Compound Namedimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane
PubChem CID161108029
Molecular FormulaC82H68Si2
Molecular Weight1109.62 g/mol
Exact Mass1108.49
IUPAC Namedimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane
SMILESCC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Si](C)(C)C1C(C)=Cc2c(-c3cccc4ccccc34)cccc21.C[Si](C)(C1C=Cc2c(-c3cccc4ccccc34)cccc21)C1C=Cc2c(-c3cccc4ccccc34)cccc21
InChIInChI=1S/C42H36Si.C40H32Si/c1-27-25-39-35(33-19-9-15-29-13-5-7-17-31(29)33)21-11-23-37(39)41(27)43(3,4)42-28(2)26-40-36(22-12-24-38(40)42)34-20-10-16-30-14-6-8-18-32(30)34;1-41(2,39-25-23-35-33(19-9-21-37(35)39)31-17-7-13-27-11-3-5-15-29(27)31)40-26-24-36-34(20-10-22-38(36)40)32-18-8-14-28-12-4-6-16-30(28)32/h5-26,41-42H,1-4H3;3-26,39-40H,1-2H3
InChIKeyUJHXNJAXVQLXPY-UHFFFAOYSA-N
XLogP22.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms84
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001109.62
LogP ≤ 522.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane?
The IUPAC name of dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane (CID 161108029) is dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane.
What is the SMILES notation for dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane?
The canonical SMILES for dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane is CC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Si](C)(C)C1C(C)=Cc2c(-c3cccc4ccccc34)cccc21.C[Si](C)(C1C=Cc2c(-c3cccc4ccccc34)cccc21)C1C=Cc2c(-c3cccc4ccccc34)cccc21.
What is the InChIKey of dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane?
The InChIKey is UJHXNJAXVQLXPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H36Si.C40H32Si/c1-27-25-39-35(33-19-9-15-29-13-5-7-17-31(29)33)21-11-23-37(39)41(27)43(3,4)42-28(2)26-40-36(22-12-24-38(40)42)34-20-10-16-30-14-6-8-18-32(30)34;1-41(2,39-25-23-35-33(19-9-21-37(35)39)31-17-7-13-27-11-3-5-15-29(27)31)40-26-24-36-34(20-10-22-38(36)40)32-18-8-14-28-12-4-6-16-30(28)32/h5-26,41-42H,1-4H3;3-26,39-40H,1-2H3.
What are the key properties of dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane?
dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane has a molecular weight of 1109.62 g/mol, XLogP of 22.85, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(2-methyl-4-naphthalen-1-yl-1H-inden-1-yl)silane;dimethyl-bis(4-naphthalen-1-yl-1H-inden-1-yl)silane is sourced from PubChem (CID 161108029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).