Cas no 5292-48-8 (Dimethyl 2-fluoro-5-nitrobenzene-1,4-dicarboxylate)
5292-48-8 structure
Product Name:Dimethyl 2-fluoro-5-nitrobenzene-1,4-dicarboxylate
CAS No:5292-48-8
MF:C10H8FNO6
MW:257.172026634216
CID:2830503
PubChem ID:16748390
Update Time:2025-04-21
Dimethyl 2-fluoro-5-nitrobenzene-1,4-dicarboxylate Chemical and Physical Properties
Names and Identifiers
-
- SCHEMBL2895340
- DTXSID70587797
- 2-Fluoro-5-nitro-terephthalic Acid Dimethyl Ester
- 1,4-Benzenedicarboxylic acid, 2-fluoro-5-nitro-, dimethyl ester
- 5292-48-8
- dimethyl 2-fluoro-5-nitroterephthalate
- Dimethyl 2-fluoro-5-nitrobenzene-1,4-dicarboxylate
-
- Inchi： 1S/C10H8FNO6/c1-17-9(13)5-4-8(12(15)16)6(3-7(5)11)10(14)18-2/h3-4H,1-2H3
- InChI Key： SNOJHMRTRDHNIB-UHFFFAOYSA-N
- SMILES： FC1=CC(C(=O)OC)=C(C=C1C(=O)OC)[N+](=O)[O-]
Computed Properties
- Exact Mass: 257.03356514Da
- Monoisotopic Mass: 257.03356514Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 355
- 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: 1.6
- Topological Polar Surface Area: 98.4?2
Dimethyl 2-fluoro-5-nitrobenzene-1,4-dicarboxylate Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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