Cas no 25222-34-8 (2,5-Cyclohexadiene-1,4-dione,2-(3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptadienyl)-5,6-dimethoxy-3-methyl-,(Z,E,E,E,E,E)- (9CI))
25222-34-8 structure
Product Name:2,5-Cyclohexadiene-1,4-dione,2-(3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptadienyl)-5,6-dimethoxy-3-methyl-,(Z,E,E,E,E,E)- (9CI)
CAS No:25222-34-8
MF:C44H66O4
MW:658.992454051971
CID:263528
PubChem ID:5289540
Update Time:2025-04-19
2,5-Cyclohexadiene-1,4-dione,2-(3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptadienyl)-5,6-dimethoxy-3-methyl-,(Z,E,E,E,E,E)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2,5-Cyclohexadiene-1,4-dione,2-(3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptadienyl)-5,6-dimethoxy-3-methyl
- 2,5-Cyclohexadiene-1,4-dione,2-(3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptadienyl)-5,6-dimethoxy-3-methyl-,(Z,E,E,E,E,E)- (9CI)
- UNII-RRK47DEG6Q
- Ubiquinone 7
- 2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl]-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione
- NSC-147790
- NSC147790
- (all-E)-2-(3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptenyl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione
- CHEBI:46448
- COQ7
- COENZYME Q7
- 4-08-00-03295 (Beilstein Handbook Reference)
- Ubiquinone 35
- 2,3-dimethoxy-5-methyl-6-heptaprenyl-1,4-benzoquinone
- 25222-34-8
- 2-((2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-Heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl)-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione
- ubiquinone(7)
- 2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione
- 2-(3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl)-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione
- 2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]-5,6-dimethoxy-3-methyl-1,4-benzoquinone
- trans-Coenzyme Q7
- UBIQUINONE-7 [JAN]
- Q27120651
- 2,5-Cyclohexadiene-1,4-dione, 2-(3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptenyl)-5,6-dimethoxy-3-methyl-, (all-E)-
- DTXSID501318261
- 2-((2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptaenyl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione
- UBIDECARENONE IMPURITY B [EP IMPURITY]
- 2,5-Cyclohexadiene-1,4-dione, 2-((2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptaenyl)-5,6-dimethoxy-3-methyl-
- coenzyme-Q7
- UQ7
- 303-95-7
- UBIQUINONE-7
- RRK47DEG6Q
- BRN 2406878
- Ubiquinone Q7
-
- Inchi： 1S/C44H66O4/c1-32(2)18-12-19-33(3)20-13-21-34(4)22-14-23-35(5)24-15-25-36(6)26-16-27-37(7)28-17-29-38(8)30-31-40-39(9)41(45)43(47-10)44(48-11)42(40)46/h18,20,22,24,26,28,30H,12-17,19,21,23,25,27,29,31H2,1-11H3/b33-20+,34-22+,35-24+,36-26+,37-28+,38-30+
- InChI Key： DBESHHFMIFSNRV-RJYQSXAYSA-N
- SMILES： O(C)C1=C(C(C(C)=C(C1=O)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)/C)=O)OC
Computed Properties
- Exact Mass: 658.496
- Monoisotopic Mass: 658.496
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 48
- Rotatable Bond Count: 22
- Complexity: 1360
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 6
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 52.6A^2
- XLogP3: 13.8
Experimental Properties
- Density: 0.98g/cm3
- Boiling Point: 736.9oC at 760mmHg
- Flash Point: 290.9oC
- Refractive Index: 1.522
- PSA: 52.60000
- LogP: 12.67440
2,5-Cyclohexadiene-1,4-dione,2-(3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptadienyl)-5,6-dimethoxy-3-methyl-,(Z,E,E,E,E,E)- (9CI) Related Literature
-
Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
25222-34-8 (2,5-Cyclohexadiene-1,4-dione,2-(3,7,11,15,19,23,27-heptamethyl-2,6,10,14,18,22,26-octacosaheptadienyl)-5,6-dimethoxy-3-methyl-,(Z,E,E,E,E,E)- (9CI)) Related Products
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