Cas no 92159-34-7 (2-(2-carboxy-5-nitrophenyl)-4-nitrobenzoic Acid)
92159-34-7 structure
Product Name:2-(2-carboxy-5-nitrophenyl)-4-nitrobenzoic Acid
CAS No:92159-34-7
MF:C14H8N2O8
MW:332.221923828125
CID:1971775
PubChem ID:257974
Update Time:2025-04-21
2-(2-carboxy-5-nitrophenyl)-4-nitrobenzoic Acid Chemical and Physical Properties
Names and Identifiers
-
- 2-(2-carboxy-5-nitrophenyl)-4-nitrobenzoic Acid
- MLS002694696
- 5.5'-Dinitro-diphenyl-dicarbonsaeure-(2.2')
- CTK5H0959
- 5,5'-dinitrobiphenyl-2,2'-dicarboxylic acid
- AC1L5XY7
- 5,5'-dinitro-diphenic acid
- NCIOpen2_009585
- HMS3087E05
- NSC86606
- AG-J-58179
- SMR001560619
- 5,5'-Dinitro-diphensaeure
- HMS3087E05;5,5'-dinitrobiphenyl-2,2'-dicarboxylic acid;5,5'-dinitro-diphenic acid;5,5'-Dinitro-diphensaeure;
- DTXSID90292972
- DTXCID90244113
- NSC-86606
- 92159-34-7
- 5,5'-dinitrodiphenic acid
- SCHEMBL7824186
-
- Inchi： 1S/C14H8N2O8/c17-13(18)9-3-1-7(15(21)22)5-11(9)12-6-8(16(23)24)2-4-10(12)14(19)20/h1-6H,(H,17,18)(H,19,20)
- InChI Key： FLZMKJSAEULZSP-UHFFFAOYSA-N
- SMILES： OC(C1C=CC(=CC=1C1C=C(C=CC=1C(=O)O)[N+](=O)[O-])[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 332.02800
- Monoisotopic Mass: 332.02806522Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 24
- Rotatable Bond Count: 3
- Complexity: 492
- 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: 2.3
- Topological Polar Surface Area: 166?2
Experimental Properties
- PSA: 166.24000
- LogP: 3.61280
2-(2-carboxy-5-nitrophenyl)-4-nitrobenzoic Acid Related Literature
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
-
Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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