[4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane

C66H70Si4 — CID 20724585

IUPAC[4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(/C=C(/c2ccc(-c3c4ccccc4c(-c4ccc(/C(=C/c5ccc([Si](C)(C)C)cc5)c5ccc([Si](C)(C)C)cc5)cc4)c4ccccc34)cc2)c2ccc([Si](C)(C)C)cc2)cc1
InChIInChI=1S/C66H70Si4/c1-67(2,3)55-37-21-47(22-38-55)45-63(51-33-41-57(42-34-51)69(7,8)9)49-25-29-53(30-26-49)65-59-17-13-15-19-61(59)66(62-20-16-14-18-60(62)65)54-31-27-50(28-32-54)64(52-35-43-58(44-36-52)70(10,11)12)46-48-23-39-56(40-24-48)68(4,5)6/h13-46H,1-12H3/b63-45-,64-46-
InChIKeyNXSJRBWZDJMTIA-GFPJCWIKSA-N
MW975.63 g/mol
LogP16.69
Rot. Bonds12

About [4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane

[4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane (PubChem CID 20724585) has the molecular formula C66H70Si4 and a molecular weight of 975.63 g/mol. Its IUPAC name is [4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane.

Molecular Properties

Compound Name[4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane
PubChem CID20724585
Molecular FormulaC66H70Si4
Molecular Weight975.63 g/mol
Exact Mass974.46
IUPAC Name[4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(/C=C(/c2ccc(-c3c4ccccc4c(-c4ccc(/C(=C/c5ccc([Si](C)(C)C)cc5)c5ccc([Si](C)(C)C)cc5)cc4)c4ccccc34)cc2)c2ccc([Si](C)(C)C)cc2)cc1
InChIInChI=1S/C66H70Si4/c1-67(2,3)55-37-21-47(22-38-55)45-63(51-33-41-57(42-34-51)69(7,8)9)49-25-29-53(30-26-49)65-59-17-13-15-19-61(59)66(62-20-16-14-18-60(62)65)54-31-27-50(28-32-54)64(52-35-43-58(44-36-52)70(10,11)12)46-48-23-39-56(40-24-48)68(4,5)6/h13-46H,1-12H3/b63-45-,64-46-
InChIKeyNXSJRBWZDJMTIA-GFPJCWIKSA-N
XLogP16.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500975.63
LogP ≤ 516.69
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'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

triphenyl-[4-[(Z)-2-phenyl-2-[4-[10-[4-[(E)-1-phenyl-2-(4-triphenylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]ethenyl]phenyl]silane
CID 20724631
9,10-bis[4-(2,2-diphenylethenyl)phenyl]anthracene
CID 3380793
9,10-bis[4-(2,2-diphenylethenyl)phenyl]anthracene;9-[4-(2,2-diphenylethenyl)phenyl]-10-[10-[4-(2,2-diphenylethenyl)phenyl]anthracen-9-yl]anthracene
CID 158494908
[4-[10-[3,5-bis[10-(4-trimethylsilylphenyl)anthracen-9-yl]phenyl]anthracen-9-yl]phenyl]-trimethylsilane
CID 58722457
9-[3,5-bis(4-phenylphenyl)phenyl]-10-[4-(2,2-diphenylethenyl)phenyl]anthracene
CID 58814327
trimethyl-[4-[4-(10-phenylanthracen-9-yl)phenyl]phenyl]silane
CID 157160990
4-[10-[4-(2,2-diphenylethenyl)phenyl]anthracen-9-yl]-N,N-diphenylaniline
CID 23067335
9-[4-[2-(4-methoxyphenyl)-2-naphthalen-2-ylethenyl]phenyl]-10-phenylanthracene
CID 72576126
9-[4-(2,2-diphenylethenyl)phenyl]-10-(2,4-diphenylphenyl)anthracene
CID 59459841
9-(2,2-diphenylethenyl)-10-[4-[10-(2,2-diphenylethenyl)anthracen-9-yl]phenyl]anthracene
CID 18335711
1-[(Z)-1,2-diphenylethenyl]-4-[4-[(Z)-1,2-diphenylethenyl]phenyl]benzene
CID 173002469
trimethyl-[4-[10-[4-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]phenyl]anthracen-9-yl]phenyl]silane
CID 59024575

Frequently Asked Questions

What is the IUPAC name of [4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane?
The IUPAC name of [4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane (CID 20724585) is [4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane.
What is the SMILES notation for [4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane?
The canonical SMILES for [4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane is C[Si](C)(C)c1ccc(/C=C(/c2ccc(-c3c4ccccc4c(-c4ccc(/C(=C/c5ccc([Si](C)(C)C)cc5)c5ccc([Si](C)(C)C)cc5)cc4)c4ccccc34)cc2)c2ccc([Si](C)(C)C)cc2)cc1.
What is the InChIKey of [4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane?
The InChIKey is NXSJRBWZDJMTIA-GFPJCWIKSA-N. The full InChI is InChI=1S/C66H70Si4/c1-67(2,3)55-37-21-47(22-38-55)45-63(51-33-41-57(42-34-51)69(7,8)9)49-25-29-53(30-26-49)65-59-17-13-15-19-61(59)66(62-20-16-14-18-60(62)65)54-31-27-50(28-32-54)64(52-35-43-58(44-36-52)70(10,11)12)46-48-23-39-56(40-24-48)68(4,5)6/h13-46H,1-12H3/b63-45-,64-46-.
What are the key properties of [4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane?
[4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane has a molecular weight of 975.63 g/mol, XLogP of 16.69, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(Z)-1-[4-[10-[4-[(Z)-1,2-bis(4-trimethylsilylphenyl)ethenyl]phenyl]anthracen-9-yl]phenyl]-2-(4-trimethylsilylphenyl)ethenyl]phenyl]-trimethylsilane is sourced from PubChem (CID 20724585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).