Cas no 40777-49-9 (Methanone, 1,3-phenylenebis[(2,4,6-trimethylphenyl)-)
40777-49-9 structure
Product Name:Methanone, 1,3-phenylenebis[(2,4,6-trimethylphenyl)-
CAS No:40777-49-9
MF:C26H26O2
MW:370.483447551727
CID:2826537
PubChem ID:10737914
Update Time:2025-04-21
Methanone, 1,3-phenylenebis[(2,4,6-trimethylphenyl)- Chemical and Physical Properties
Names and Identifiers
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- DTXSID80444201
- 40777-49-9
- Methanone, 1,3-phenylenebis[(2,4,6-trimethylphenyl)-
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- Inchi： 1S/C26H26O2/c1-15-10-17(3)23(18(4)11-15)25(27)21-8-7-9-22(14-21)26(28)24-19(5)12-16(2)13-20(24)6/h7-14H,1-6H3
- InChI Key： XJFPHSWYBDBNTB-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=C(C=1)C(C1C(C)=CC(C)=CC=1C)=O)C1C(C)=CC(C)=CC=1C
Computed Properties
- Exact Mass: 370.193280068Da
- Monoisotopic Mass: 370.193280068Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 28
- Rotatable Bond Count: 4
- Complexity: 495
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 6.8
- Topological Polar Surface Area: 34.1?2
Methanone, 1,3-phenylenebis[(2,4,6-trimethylphenyl)- Related Literature
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Veluru Jagadeesh babu,Sesha Vempati RSC Adv., 2015,5, 66367-66375
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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