Cas no 102489-80-5 (Ethanethiol,2-[(2,1,3-benzothiadiazol-4-ylmethyl)amino]-)
![Ethanethiol,2-[(2,1,3-benzothiadiazol-4-ylmethyl)amino]- structure](https://ossimg.kuujia.com/scimg/102500/102489-80-5x500.png)
102489-80-5 structure
Product Name:Ethanethiol,2-[(2,1,3-benzothiadiazol-4-ylmethyl)amino]-
CAS No:102489-80-5
MF:C9H11N3S2
MW:225.333738565445
CID:206143
Update Time:2024-01-26
Ethanethiol,2-[(2,1,3-benzothiadiazol-4-ylmethyl)amino]- Chemical and Physical Properties
Names and Identifiers
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- Ethanethiol,2-[(2,1,3-benzothiadiazol-4-ylmethyl)amino]-
- 2,1,3-Benzothiadiazole,ethanethiol deriv.
- Ethanethiol, 2-[(2,1,3-benzothiadiazol-4-ylmethyl)amino]-
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- Inchi： 1S/C9H11N3S2/c13-5-4-10-6-7-2-1-3-8-9(7)12-14-11-8/h1-3,10,13H,4-6H2
- InChI Key： WAAKYAKFNWTZAZ-UHFFFAOYSA-N
- SMILES： C(S)CNCC1C2C(C=CC=1)=NSN=2
Computed Properties
- Exact Mass: 305.00596
Experimental Properties
- Density: 1.312±0.06 g/cm3(Predicted)
- Boiling Point: 346.4±22.0 °C(Predicted)
- PSA: 37.81
- pka: 9.97±0.10(Predicted)
Ethanethiol,2-[(2,1,3-benzothiadiazol-4-ylmethyl)amino]- Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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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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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Jason Wan Lab Chip, 2020,20, 4528-4538
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