Cas no 53553-04-1 (Benzoic acid, 2,6-dichloro-3-(1-piperidinylsulfonyl)-)
53553-04-1 structure
Product Name:Benzoic acid, 2,6-dichloro-3-(1-piperidinylsulfonyl)-
CAS No:53553-04-1
MF:C12H13Cl2NO4S
MW:338.206920385361
CID:1582836
Update Time:2024-09-11
Benzoic acid, 2,6-dichloro-3-(1-piperidinylsulfonyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 2,6-dichloro-3-(1-piperidinylsulfonyl)-
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- Inchi： 1S/C12H13Cl2NO4S/c13-8-4-5-9(11(14)10(8)12(16)17)20(18,19)15-6-2-1-3-7-15/h4-5H,1-3,6-7H2,(H,16,17)
- InChI Key： JYCGDLQLSSEUCZ-UHFFFAOYSA-N
- SMILES： C(O)(=O)C1=C(Cl)C=CC(S(N2CCCCC2)(=O)=O)=C1Cl
Computed Properties
- Exact Mass: 336.99439
Experimental Properties
- Density: 1.528±0.06 g/cm3(Predicted)
- Boiling Point: 504.9±60.0 °C(Predicted)
- PSA: 74.68
- pka: 1.26±0.25(Predicted)
Benzoic acid, 2,6-dichloro-3-(1-piperidinylsulfonyl)- Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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