5-(2,6-Dimethyl-8-(2,6,6-trimethylcyclohexen-1-yl)-1,3,5,7-octatetraen-1-yl)tetrazole,trans

Base Information

• Chemical Name: 5-(2,6-Dimethyl-8-(2,6,6-trimethylcyclohexen-1-yl)-1,3,5,7-octatetraen-1-yl)tetrazole,trans
• CAS No.: 74597-00-5
• Molecular Formula: C20H28N4
• Molecular Weight: 324.4631
• ChEMBL ID: CHEMBL7395

Synonyms:WH09;5-(2,6-Dimethyl-8-(2,6,6-trimethyl-1-cyclohexen-1-yl)octa 1,3,5,7-tetraen-1-yl)tetrazole,trans;5-(2,6-Dimethyl-8-(2,6,6-trimethylcyclohexen-1-yl)-1,3,5,7-octatetraen-1-yl)tetrazole,trans;74597-00-5;all-trans-5-(2,6-Dimethyl-8-(2,6,6-trimethylcyclohexen-1-yl)-1,3,5,7-octatetraen-1-yl)tetrazole;CHEMBL7395;SCHEMBL18071581

Chemical Property of 5-(2,6-Dimethyl-8-(2,6,6-trimethylcyclohexen-1-yl)-1,3,5,7-octatetraen-1-yl)tetrazole,trans

Chemical Property:

• Vapor Pressure: 4.26E-10mmHg at 25°C
• Boiling Point: 499.1°Cat760mmHg
• Flash Point: 214.2°C
• Density: 1.071g/cm³
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 324.23139691
• Heavy Atom Count: 24
• Complexity: 591

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC2=NNN=N2)C)C
• Isomeric SMILES: CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C2=NNN=N2)/C)/C

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