Coenzyme Q10, (2Z)-

Base Information

• Chemical Name: Coenzyme Q10, (2Z)-
• CAS No.: 65085-29-2
• Molecular Formula: C59H90O4
• Molecular Weight: 863.361
• UNII: U705VLF0VW
• Nikkaji Number: J2.291.667J
• Wikidata: Q27290775
• Mol file: 65085-29-2.mol

Synonyms:Coenzyme Q10, (2Z)-;Ubidecarenone (2Z) isomer;65085-29-2;Coenzyme Q10 (2Z) isomer;(2Z)-coenzyme q10;U705VLF0VW;2,5-Cyclohexadiene-1,4-dione, 2-((2Z,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaenyl)-5,6-dimethoxy-3-methyl- (9ci);2,5-Cyclohexadiene-1,4-dione, 2-(3,7,11,15,19,23,27,31,35,39-decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaenyl)-5,6-dimethoxy-3-methyl-, (Z,E,E,E,E,E,E,E,E)-;UNII-U705VLF0VW;SCHEMBL13026488;UBIDECARENONE IMPURITY F [EP IMPURITY];Q27290775;2-((2Z,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-Decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl)-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione;2-[(2Z,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl]-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione

Chemical Property of Coenzyme Q10, (2Z)-

Chemical Property:

• XLogP3: 19.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 31
• Exact Mass: 862.68391135
• Heavy Atom Count: 63
• Complexity: 1840

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C(=O)C(=C(C1=O)OC)OC)CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C
• Isomeric SMILES: CC1=C(C(=O)C(=C(C1=O)OC)OC)C/C=C(/C)\CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C

Technology Process of Coenzyme Q10, (2Z)-

There total 28 articles about Coenzyme Q10, (2Z)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 72.0%

1-((2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-Decamethyl-tetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl)-2,3,4,5-tetramethoxy-6-methyl-benzene (3066-88-4,94828-17-8) → 2-((2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-Decamethyl-tetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl)-5,6-dimethoxy-3-methyl-[1,4]benzoquinone (303-98-0,27696-12-4,40819-90-7,60684-33-5,65085-29-2,110012-76-5,117707-52-5,55127-92-9)

Guidance literature:

With ammonium cerium(IV) nitrate; In dichloromethane; acetonitrile; at 0 ℃; for 0.0833333h;

DOI:10.1055/s-1991-28404

Reference yield:

2-((2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-Decamethyl-tetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl)-5,6-dimethoxy-3-methyl-benzene-1,4-diol (947156-48-1) → ubidecarenone (303-98-0,55127-92-9) + 2-((2Z,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyl-tetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl)-5,6-dimethoxy-3-methyl-[1,4]benzoquinone (65085-29-2,55127-92-9)

Guidance literature:

With manganese(IV) oxide; In diethyl ether; at 0 ℃; Yield given. Yields of byproduct given;

DOI:10.1246/cl.1982.1131

Reference yield:

2,3-dimethoxy-5-methylbenzene-1,4-diol (3066-90-8) + 3,7,11,15,19,23,27,31,35,39-decamethyl-1,6,10,14,18,22,26,30,34,38-tetracontadecaene-3-ol (59640-02-7) → ubidecarenone (303-98-0,55127-92-9) + 2-((2Z,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyl-tetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl)-5,6-dimethoxy-3-methyl-[1,4]benzoquinone (65085-29-2,55127-92-9)

Guidance literature:

With boron trifluoride diethyl etherate; Yield given. Multistep reaction. Yields of byproduct given; 1) hexane, nitromethane, 10 min, 43 deg C, 2) 2-propanol, RT, 1 h;

DOI:10.1246/cl.1988.1597

upstream raw materials:

2,3-dimethoxy-5-methylbenzene-1,4-diol

3,7,11,15,19,23,27,31,35,39-decamethyl-1,6,10,14,18,22,26,30,34,38-tetracontadecaene-3-ol

2-((2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-Decamethyl-tetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl)-5,6-dimethoxy-3-methyl-benzene-1,4-diol

Decaprenyl bromide