bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene

C24H34N2 — CID 10247336

IUPACbis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene
SMILESCc1cc(C)c(C(C)(C)/N=N/C(C)(C)c2c(C)cc(C)cc2C)c(C)c1
InChIInChI=1S/C24H34N2/c1-15-11-17(3)21(18(4)12-15)23(7,8)25-26-24(9,10)22-19(5)13-16(2)14-20(22)6/h11-14H,1-10H3/b26-25+
InChIKeyZHPMUBJIRQHXEQ-OCEACIFDSA-N
MW350.55 g/mol
LogP7.16
Rot. Bonds4

About bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene

bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene (PubChem CID 10247336) has the molecular formula C24H34N2 and a molecular weight of 350.55 g/mol. Its IUPAC name is bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene.

Molecular Properties

Compound Namebis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene
PubChem CID10247336
Molecular FormulaC24H34N2
Molecular Weight350.55 g/mol
Exact Mass350.27
IUPAC Namebis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene
SMILESCc1cc(C)c(C(C)(C)/N=N/C(C)(C)c2c(C)cc(C)cc2C)c(C)c1
InChIInChI=1S/C24H34N2/c1-15-11-17(3)21(18(4)12-15)23(7,8)25-26-24(9,10)22-19(5)13-16(2)14-20(22)6/h11-14H,1-10H3/b26-25+
InChIKeyZHPMUBJIRQHXEQ-OCEACIFDSA-N
XLogP7.16
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.55
LogP ≤ 57.16
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'}

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Frequently Asked Questions

What is the IUPAC name of bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene?
The IUPAC name of bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene (CID 10247336) is bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene.
What is the SMILES notation for bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene?
The canonical SMILES for bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene is Cc1cc(C)c(C(C)(C)/N=N/C(C)(C)c2c(C)cc(C)cc2C)c(C)c1.
What is the InChIKey of bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene?
The InChIKey is ZHPMUBJIRQHXEQ-OCEACIFDSA-N. The full InChI is InChI=1S/C24H34N2/c1-15-11-17(3)21(18(4)12-15)23(7,8)25-26-24(9,10)22-19(5)13-16(2)14-20(22)6/h11-14H,1-10H3/b26-25+.
What are the key properties of bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene?
bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene has a molecular weight of 350.55 g/mol, XLogP of 7.16, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene is sourced from PubChem (CID 10247336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).