Cas no 171406-81-8 (Benzoic acid, 4-[(hydroxymethylamino)sulfonyl]-)
![Benzoic acid, 4-[(hydroxymethylamino)sulfonyl]- structure](https://ossimg.kuujia.com/scimg/171500/171406-81-8x500.png)
171406-81-8 structure
Product Name:Benzoic acid, 4-[(hydroxymethylamino)sulfonyl]-
CAS No:171406-81-8
MF:C8H9NO5S
MW:231.225761175156
CID:1358661
Update Time:2024-08-17
Benzoic acid, 4-[(hydroxymethylamino)sulfonyl]- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 4-[(hydroxymethylamino)sulfonyl]-
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- Inchi： 1S/C8H9NO5S/c10-5-9-15(13,14)7-3-1-6(2-4-7)8(11)12/h1-4,9-10H,5H2,(H,11,12)
- InChI Key： MFIUDJVJRUFAGG-UHFFFAOYSA-N
- SMILES： C(O)(=O)C1=CC=C(S(NCO)(=O)=O)C=C1
Computed Properties
- Exact Mass: 231.02017
Experimental Properties
- Density: 1.557±0.06 g/cm3(Predicted)
- Boiling Point: 462.0±47.0 °C(Predicted)
- PSA: 103.7
- pka: 3.44±0.10(Predicted)
Benzoic acid, 4-[(hydroxymethylamino)sulfonyl]- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
171406-81-8 (Benzoic acid, 4-[(hydroxymethylamino)sulfonyl]-) Related Products
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