Cas no 35740-94-4 ([1,1':2',1''-Terphenyl]-3',4'-dicarboxylic acid, 5'-phenyl-, dimethyl ester)
![[1,1':2',1''-Terphenyl]-3',4'-dicarboxylic acid, 5'-phenyl-, dimethyl ester structure](https://ossimg.kuujia.com/scimg/36000/35740-94-4x500.png)
35740-94-4 structure
Product Name:[1,1':2',1''-Terphenyl]-3',4'-dicarboxylic acid, 5'-phenyl-, dimethyl ester
CAS No:35740-94-4
MF:C28H22O4
MW:422.471888065338
CID:1472926
PubChem ID:71360858
Update Time:2025-04-20
[1,1':2',1''-Terphenyl]-3',4'-dicarboxylic acid, 5'-phenyl-, dimethyl ester Chemical and Physical Properties
Names and Identifiers
-
- [1,1':2',1''-Terphenyl]-3',4'-dicarboxylic acid, 5'-phenyl-, dimethyl ester
- dimethyl 3,4,6-triphenylbenzene-1,2-dicarboxylate
- 35740-94-4
- DTXSID70784623
-
- Inchi： 1S/C28H22O4/c1-31-27(29)25-23(20-14-8-4-9-15-20)18-22(19-12-6-3-7-13-19)24(26(25)28(30)32-2)21-16-10-5-11-17-21/h3-18H,1-2H3
- InChI Key： SOMDYSYUOWJCEA-UHFFFAOYSA-N
- SMILES： O(C)C(C1C(C(=O)OC)=C(C2C=CC=CC=2)C=C(C2C=CC=CC=2)C=1C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 422.15186
- Monoisotopic Mass: 422.15180918g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 32
- Rotatable Bond Count: 7
- Complexity: 613
- 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: 6.5
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
[1,1':2',1''-Terphenyl]-3',4'-dicarboxylic acid, 5'-phenyl-, dimethyl ester Related Literature
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Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Pavel Karásek,Jakub Grym,Michal Roth,Josef Planeta,Franti?ek Foret Lab Chip, 2015,15, 311-318
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
35740-94-4 ([1,1':2',1''-Terphenyl]-3',4'-dicarboxylic acid, 5'-phenyl-, dimethyl ester) Related Products
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