Cas no 213012-84-1 (Benzoic acid, 2-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]-)
![Benzoic acid, 2-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]- structure](https://ossimg.kuujia.com/scimg/213500/213012-84-1x500.png)
213012-84-1 structure
Product Name:Benzoic acid, 2-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]-
CAS No:213012-84-1
MF:C19H21NO4S
MW:359.439344167709
CID:1399987
Update Time:2024-08-15
Benzoic acid, 2-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 2-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]-
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- Inchi： 1S/C19H21NO4S/c21-19(22)17-8-4-5-9-18(17)25(23,24)20-12-10-16(11-13-20)14-15-6-2-1-3-7-15/h1-9,16H,10-14H2,(H,21,22)
- InChI Key： DWLSDPDLBLIQCJ-UHFFFAOYSA-N
- SMILES： C(O)(=O)C1=CC=CC=C1S(N1CCC(CC2=CC=CC=C2)CC1)(=O)=O
Computed Properties
- Exact Mass: 359.11923
Experimental Properties
- Density: 1.304±0.06 g/cm3(Predicted)
- Boiling Point: 552.0±52.0 °C(Predicted)
- PSA: 74.68
- pka: 3.30±0.36(Predicted)
Benzoic acid, 2-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]- Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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