Cas no 142576-96-3 (Benzoic acid, 2,6-dichloro-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-)
![Benzoic acid, 2,6-dichloro-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]- structure](https://ossimg.kuujia.com/scimg/143000/142576-96-3x500.png)
142576-96-3 structure
Product Name:Benzoic acid, 2,6-dichloro-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-
CAS No:142576-96-3
MF:C18H18Cl2N2O4S
MW:429.317521572113
CID:1316615
Update Time:2024-08-18
Benzoic acid, 2,6-dichloro-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 2,6-dichloro-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-
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- Inchi： 1S/C18H18Cl2N2O4S/c19-14-6-7-15(17(20)16(14)18(23)24)27(25,26)22-10-8-21(9-11-22)12-13-4-2-1-3-5-13/h1-7H,8-12H2,(H,23,24)
- InChI Key： HQVOHBLUQUNATA-UHFFFAOYSA-N
- SMILES： C(O)(=O)C1=C(Cl)C=CC(S(N2CCN(CC3=CC=CC=C3)CC2)(=O)=O)=C1Cl
Computed Properties
- Exact Mass: 428.03664
Experimental Properties
- Density: 1.477±0.06 g/cm3(Predicted)
- Boiling Point: 583.1±60.0 °C(Predicted)
- PSA: 77.92
- pka: 1.18±0.25(Predicted)
Benzoic acid, 2,6-dichloro-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]- Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
142576-96-3 (Benzoic acid, 2,6-dichloro-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-) Related Products
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