Boviquinone 4

Base Information

• Chemical Name: Boviquinone 4
• CAS No.: 28129-52-4
• Molecular Formula: C₂₆H₃₆O₄
• Molecular Weight: 412.569
• UNII: TFA3BH8YTC
• DSSTox Substance ID: DTXSID501109434
• Nikkaji Number: J16.992G
• Mol file: 28129-52-4.mol

Synonyms:Boviquinone 4;Bovinone;28129-52-4;2,5-Dihydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl]-2,5-cyclohexadiene-1,4-dione;Bovinon;Boviquinone-4;TFA3BH8YTC;CHEBI:176033;DTXSID501109434;2,5-dihydroxy-3-geranylgeranyl-1,4-benzoquinone;3-Geranylgeranyl-2,5-dihydroxy-1,4-benzoquinone;2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-, (E,E,E)-;2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl]-;2,5-dihydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]cyclohexa-2,5-diene-1,4-dione;p-Benzoquinone, 2,5-dihydroxy-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-, (E,E,E)-

Chemical Property of Boviquinone 4

Chemical Property:

• PSA: 74.60000
• LogP: 6.92800
• XLogP3: 7.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 11
• Exact Mass: 412.26135963
• Heavy Atom Count: 30
• Complexity: 825

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCCC(=CCCC(=CCCC(=CCC1=C(C(=O)C=C(C1=O)O)O)C)C)C)C
• Isomeric SMILES: CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC1=C(C(=O)C=C(C1=O)O)O)/C)/C)/C)C