Cas no 59208-93-4 (6-chloro-3-Cinnolinecarboxylic acid)
59208-93-4 structure
Product Name:6-chloro-3-Cinnolinecarboxylic acid
CAS No:59208-93-4
MF:C9H5ClN2O2
MW:208.601200819016
CID:1114580
Update Time:2024-07-24
6-chloro-3-Cinnolinecarboxylic acid Chemical and Physical Properties
Names and Identifiers
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- 6-chloro-3-Cinnolinecarboxylic acid
- 3-Cinnolinecarboxylic acid, 6-chloro-
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- Inchi： 1S/C9H5ClN2O2/c10-6-1-2-7-5(3-6)4-8(9(13)14)12-11-7/h1-4H,(H,13,14)
- InChI Key： RQPKPZSTIWQUAY-UHFFFAOYSA-N
- SMILES： N1=C2C(C=C(Cl)C=C2)=CC(C(O)=O)=N1
Computed Properties
- Exact Mass: 208.00405
Experimental Properties
- Density: 1.551±0.06 g/cm3(Predicted)
- Boiling Point: 413.9±53.0 °C(Predicted)
- PSA: 63.08
- pka: 2.73±0.30(Predicted)
6-chloro-3-Cinnolinecarboxylic acid Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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