Cas no 7401-89-0 (2,4,5,6-tetrachlorobenzene-1,3-dicarboxylic Acid)
7401-89-0 structure
Product Name:2,4,5,6-tetrachlorobenzene-1,3-dicarboxylic Acid
CAS No:7401-89-0
MF:C8H2Cl4O4
MW:303.911078929901
CID:978794
PubChem ID:235870
Update Time:2025-04-19
2,4,5,6-tetrachlorobenzene-1,3-dicarboxylic Acid Chemical and Physical Properties
Names and Identifiers
-
- 2,4,5,6-tetrachlorobenzene-1,3-dicarboxylic Acid
- AC1L5VCE
- AC1Q3KZV
- AG-K-86375
- AR-1D2915
- CTK5D9163
- NSC37661
- perchloroisophthalic acid
- Tetrachlor-isophthalsaeure
- tetrachloro-isophthalic acid
- Tetrachloroisophthalic acid
- NSC 37661
- SCHEMBL5406015
- 7401-89-0
- NS00006272
- DTXSID60284566
- NSC-37661
- UVGODUOYFYEIGZ-UHFFFAOYSA-N
-
- Inchi： 1S/C8H2Cl4O4/c9-3-1(7(13)14)4(10)6(12)5(11)2(3)8(15)16/h(H,13,14)(H,15,16)
- InChI Key： UVGODUOYFYEIGZ-UHFFFAOYSA-N
- SMILES： ClC1C(C(=O)O)=C(C(=C(C=1C(=O)O)Cl)Cl)Cl
Computed Properties
- Exact Mass: 301.87086
- Monoisotopic Mass: 301.871
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 282
- 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: 3.7
- Topological Polar Surface Area: 74.6?2
Experimental Properties
- Density: 1.872
- Boiling Point: 452°C at 760 mmHg
- Flash Point: 227.2°C
- Refractive Index: 1.656
- PSA: 74.6
2,4,5,6-tetrachlorobenzene-1,3-dicarboxylic Acid Related Literature
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
-
Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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