bis(4-methyl-2-triethoxysilylphenyl)diazene

C26H42N2O6Si2 — CID 102150586

IUPACbis(4-methyl-2-triethoxysilylphenyl)diazene
SMILESCCO[Si](OCC)(OCC)c1cc(C)ccc1/N=N/c1ccc(C)cc1[Si](OCC)(OCC)OCC
InChIInChI=1S/C26H42N2O6Si2/c1-9-29-35(30-10-2,31-11-3)25-19-21(7)15-17-23(25)27-28-24-18-16-22(8)20-26(24)36(32-12-4,33-13-5)34-14-6/h15-20H,9-14H2,1-8H3/b28-27+
InChIKeyMEDVHAVOYMMUTB-BYYHNAKLSA-N
MW534.80 g/mol
LogP5.23
Rot. Bonds16

About bis(4-methyl-2-triethoxysilylphenyl)diazene

bis(4-methyl-2-triethoxysilylphenyl)diazene (PubChem CID 102150586) has the molecular formula C26H42N2O6Si2 and a molecular weight of 534.80 g/mol. Its IUPAC name is bis(4-methyl-2-triethoxysilylphenyl)diazene.

Molecular Properties

Compound Namebis(4-methyl-2-triethoxysilylphenyl)diazene
PubChem CID102150586
Molecular FormulaC26H42N2O6Si2
Molecular Weight534.80 g/mol
Exact Mass534.26
IUPAC Namebis(4-methyl-2-triethoxysilylphenyl)diazene
SMILESCCO[Si](OCC)(OCC)c1cc(C)ccc1/N=N/c1ccc(C)cc1[Si](OCC)(OCC)OCC
InChIInChI=1S/C26H42N2O6Si2/c1-9-29-35(30-10-2,31-11-3)25-19-21(7)15-17-23(25)27-28-24-18-16-22(8)20-26(24)36(32-12-4,33-13-5)34-14-6/h15-20H,9-14H2,1-8H3/b28-27+
InChIKeyMEDVHAVOYMMUTB-BYYHNAKLSA-N
XLogP5.23
TPSA80.10 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500534.80
LogP ≤ 55.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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'}

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Related Compounds

bis(4-methyl-2-trifluorosilylphenyl)diazene
CID 102150589
bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene
CID 25136863
triethoxy-(4-methoxy-2-triethoxysilylphenyl)silane
CID 59566622
(4,5-dimethoxy-2-methylphenyl)-triethoxysilane
CID 59566613
anthracen-1-yl(triethoxy)silane
CID 87178396
triethoxy-(5-triethoxysilylthiophen-2-yl)silane
CID 15466978
(4-methyl-2-trimethoxysilylphenyl)methanethiol
CID 22005762
ethoxy-methyl-(4-methylphenyl)-trimethylsilylsilane
CID 139631947
ethane;triethoxy(phenyl)silane
CID 174836592
N,N-dimethyl-1-(2-triethoxysilylphenyl)methanamine
CID 71411551
1-(2-triethoxysilylphenyl)ethanone
CID 175456342
triethoxy-[1-(3-methylphenyl)ethyl]silane
CID 139239900

Frequently Asked Questions

What is the IUPAC name of bis(4-methyl-2-triethoxysilylphenyl)diazene?
The IUPAC name of bis(4-methyl-2-triethoxysilylphenyl)diazene (CID 102150586) is bis(4-methyl-2-triethoxysilylphenyl)diazene.
What is the SMILES notation for bis(4-methyl-2-triethoxysilylphenyl)diazene?
The canonical SMILES for bis(4-methyl-2-triethoxysilylphenyl)diazene is CCO[Si](OCC)(OCC)c1cc(C)ccc1/N=N/c1ccc(C)cc1[Si](OCC)(OCC)OCC.
What is the InChIKey of bis(4-methyl-2-triethoxysilylphenyl)diazene?
The InChIKey is MEDVHAVOYMMUTB-BYYHNAKLSA-N. The full InChI is InChI=1S/C26H42N2O6Si2/c1-9-29-35(30-10-2,31-11-3)25-19-21(7)15-17-23(25)27-28-24-18-16-22(8)20-26(24)36(32-12-4,33-13-5)34-14-6/h15-20H,9-14H2,1-8H3/b28-27+.
What are the key properties of bis(4-methyl-2-triethoxysilylphenyl)diazene?
bis(4-methyl-2-triethoxysilylphenyl)diazene has a molecular weight of 534.80 g/mol, XLogP of 5.23, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-methyl-2-triethoxysilylphenyl)diazene is sourced from PubChem (CID 102150586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).