[4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane

C74H58Si2 — CID 123803686

IUPAC[4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane
SMILESC[Si](C)(c1ccc(-c2c3ccccc3c(-c3ccc([Si](C)(C)c4ccc5c6c4C=CC4=CC=C(c7ccccc7)C(=CC5)C46)cc3)c3ccccc23)cc1)c1ccc2c3c1C=CC1=CC=C(c4ccccc4)C(=CC2)C13
InChIInChI=1S/C74H58Si2/c1-75(2,67-45-33-53-29-41-63-57(47-15-7-5-8-16-47)39-27-51-31-43-65(67)73(53)71(51)63)55-35-23-49(24-36-55)69-59-19-11-13-21-61(59)70(62-22-14-12-20-60(62)69)50-25-37-56(38-26-50)76(3,4)68-46-34-54-30-42-64-58(48-17-9-6-10-18-48)40-28-52-32-44-66(68)74(54)72(52)64/h5-28,31-46,71-72H,29-30H2,1-4H3
InChIKeyVCRNMXQHDVQFSR-UHFFFAOYSA-N
MW1003.45 g/mol
LogP16.21
Rot. Bonds8

About [4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane

[4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane (PubChem CID 123803686) has the molecular formula C74H58Si2 and a molecular weight of 1003.45 g/mol. Its IUPAC name is [4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane.

Molecular Properties

Compound Name[4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane
PubChem CID123803686
Molecular FormulaC74H58Si2
Molecular Weight1003.45 g/mol
Exact Mass1002.41
IUPAC Name[4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane
SMILESC[Si](C)(c1ccc(-c2c3ccccc3c(-c3ccc([Si](C)(C)c4ccc5c6c4C=CC4=CC=C(c7ccccc7)C(=CC5)C46)cc3)c3ccccc23)cc1)c1ccc2c3c1C=CC1=CC=C(c4ccccc4)C(=CC2)C13
InChIInChI=1S/C74H58Si2/c1-75(2,67-45-33-53-29-41-63-57(47-15-7-5-8-16-47)39-27-51-31-43-65(67)73(53)71(51)63)55-35-23-49(24-36-55)69-59-19-11-13-21-61(59)70(62-22-14-12-20-60(62)69)50-25-37-56(38-26-50)76(3,4)68-46-34-54-30-42-64-58(48-17-9-6-10-18-48)40-28-52-32-44-66(68)74(54)72(52)64/h5-28,31-46,71-72H,29-30H2,1-4H3
InChIKeyVCRNMXQHDVQFSR-UHFFFAOYSA-N
XLogP16.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms76
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001003.45
LogP ≤ 516.21
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 [4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane?
The IUPAC name of [4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane (CID 123803686) is [4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane.
What is the SMILES notation for [4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane?
The canonical SMILES for [4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane is C[Si](C)(c1ccc(-c2c3ccccc3c(-c3ccc([Si](C)(C)c4ccc5c6c4C=CC4=CC=C(c7ccccc7)C(=CC5)C46)cc3)c3ccccc23)cc1)c1ccc2c3c1C=CC1=CC=C(c4ccccc4)C(=CC2)C13.
What is the InChIKey of [4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane?
The InChIKey is VCRNMXQHDVQFSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H58Si2/c1-75(2,67-45-33-53-29-41-63-57(47-15-7-5-8-16-47)39-27-51-31-43-65(67)73(53)71(51)63)55-35-23-49(24-36-55)69-59-19-11-13-21-61(59)70(62-22-14-12-20-60(62)69)50-25-37-56(38-26-50)76(3,4)68-46-34-54-30-42-64-58(48-17-9-6-10-18-48)40-28-52-32-44-66(68)74(54)72(52)64/h5-28,31-46,71-72H,29-30H2,1-4H3.
What are the key properties of [4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane?
[4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane has a molecular weight of 1003.45 g/mol, XLogP of 16.21, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[10-[4-[dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silyl]phenyl]anthracen-9-yl]phenyl]-dimethyl-(6-phenyl-4,10c-dihydropyren-1-yl)silane is sourced from PubChem (CID 123803686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).