bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene

C38H32F2N2Si2 — CID 25136863

IUPACbis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene
SMILESCc1ccc(/N=N/c2ccc(C)cc2[Si](F)(c2ccccc2)c2ccccc2)c([Si](F)(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C38H32F2N2Si2/c1-29-23-25-35(37(27-29)43(39,31-15-7-3-8-16-31)32-17-9-4-10-18-32)41-42-36-26-24-30(2)28-38(36)44(40,33-19-11-5-12-20-33)34-21-13-6-14-22-34/h3-28H,1-2H3/b42-41+
InChIKeyNTRPSYAMZTYHFB-WQVHNPAPSA-N
MW610.86 g/mol
LogP6.59
Rot. Bonds8

About bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene

bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene (PubChem CID 25136863) has the molecular formula C38H32F2N2Si2 and a molecular weight of 610.86 g/mol. Its IUPAC name is bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene.

Molecular Properties

Compound Namebis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene
PubChem CID25136863
Molecular FormulaC38H32F2N2Si2
Molecular Weight610.86 g/mol
Exact Mass610.21
IUPAC Namebis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene
SMILESCc1ccc(/N=N/c2ccc(C)cc2[Si](F)(c2ccccc2)c2ccccc2)c([Si](F)(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C38H32F2N2Si2/c1-29-23-25-35(37(27-29)43(39,31-15-7-3-8-16-31)32-17-9-4-10-18-32)41-42-36-26-24-30(2)28-38(36)44(40,33-19-11-5-12-20-33)34-21-13-6-14-22-34/h3-28H,1-2H3/b42-41+
InChIKeyNTRPSYAMZTYHFB-WQVHNPAPSA-N
XLogP6.59
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500610.86
LogP ≤ 56.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

bis(4-methyl-2-trifluorosilylphenyl)diazene
CID 102150589
bis(4-methyl-2-triethoxysilylphenyl)diazene
CID 102150586
[2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene
CID 21342367
benzene;2-[(2-hydroxy-5-methylphenyl)diazenyl]-4-methylphenol
CID 160570750
(2-methoxy-5-methylphenyl)-dimethyl-phenylsilane
CID 101027694
[2-[methyl(diphenyl)silyl]phenyl]-phenyldiazene
CID 139118290
[4-(4-methylphenyl)phenyl]-triphenylsilane
CID 123512514
chloro-(2,5-dimethylphenyl)-(3,5-dimethylphenyl)-phenylsilane
CID 88962443
[bis(4-methylphenyl)-phenylsilyl]-bis(4-methylphenyl)-phenylsilane
CID 5077893
(4-methylphenyl)-diphenyl-triphenylsilylsilane
CID 4518674
4-methyl-2-[(4-phenyldiazenylphenyl)diazenyl]phenol
CID 3519903
N-(5-methyl-2-phenyldiazenylphenyl)acetamide
CID 154602849

Frequently Asked Questions

What is the IUPAC name of bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene?
The IUPAC name of bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene (CID 25136863) is bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene.
What is the SMILES notation for bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene?
The canonical SMILES for bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene is Cc1ccc(/N=N/c2ccc(C)cc2[Si](F)(c2ccccc2)c2ccccc2)c([Si](F)(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene?
The InChIKey is NTRPSYAMZTYHFB-WQVHNPAPSA-N. The full InChI is InChI=1S/C38H32F2N2Si2/c1-29-23-25-35(37(27-29)43(39,31-15-7-3-8-16-31)32-17-9-4-10-18-32)41-42-36-26-24-30(2)28-38(36)44(40,33-19-11-5-12-20-33)34-21-13-6-14-22-34/h3-28H,1-2H3/b42-41+.
What are the key properties of bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene?
bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene has a molecular weight of 610.86 g/mol, XLogP of 6.59, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene is sourced from PubChem (CID 25136863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).