trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane

C38H32Si — CID 59861211

IUPACtrimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane
SMILESCc1ccc(-c2c3ccccc3c(-c3ccc([Si](C)(C)C)c4ccccc34)c3ccccc23)c2ccccc12
InChIInChI=1S/C38H32Si/c1-25-21-22-34(27-14-6-5-13-26(25)27)37-30-17-9-11-19-32(30)38(33-20-12-10-18-31(33)37)35-23-24-36(39(2,3)4)29-16-8-7-15-28(29)35/h5-24H,1-4H3
InChIKeyKZEPJZZMVHHWLK-UHFFFAOYSA-N
MW516.76 g/mol
LogP10.49
Rot. Bonds3

About trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane

trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane (PubChem CID 59861211) has the molecular formula C38H32Si and a molecular weight of 516.76 g/mol. Its IUPAC name is trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane.

Molecular Properties

Compound Nametrimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane
PubChem CID59861211
Molecular FormulaC38H32Si
Molecular Weight516.76 g/mol
Exact Mass516.23
IUPAC Nametrimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane
SMILESCc1ccc(-c2c3ccccc3c(-c3ccc([Si](C)(C)C)c4ccccc34)c3ccccc23)c2ccccc12
InChIInChI=1S/C38H32Si/c1-25-21-22-34(27-14-6-5-13-26(25)27)37-30-17-9-11-19-32(30)38(33-20-12-10-18-31(33)37)35-23-24-36(39(2,3)4)29-16-8-7-15-28(29)35/h5-24H,1-4H3
InChIKeyKZEPJZZMVHHWLK-UHFFFAOYSA-N
XLogP10.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500516.76
LogP ≤ 510.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane?
The IUPAC name of trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane (CID 59861211) is trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane.
What is the SMILES notation for trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane?
The canonical SMILES for trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane is Cc1ccc(-c2c3ccccc3c(-c3ccc([Si](C)(C)C)c4ccccc34)c3ccccc23)c2ccccc12.
What is the InChIKey of trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane?
The InChIKey is KZEPJZZMVHHWLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H32Si/c1-25-21-22-34(27-14-6-5-13-26(25)27)37-30-17-9-11-19-32(30)38(33-20-12-10-18-31(33)37)35-23-24-36(39(2,3)4)29-16-8-7-15-28(29)35/h5-24H,1-4H3.
What are the key properties of trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane?
trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane has a molecular weight of 516.76 g/mol, XLogP of 10.49, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-[10-(4-methylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]silane is sourced from PubChem (CID 59861211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).