Cas no 22094-96-8 (Ethanol,2-[(5-amino-2-methoxyphenyl)sulfonyl]-)
22094-96-8 structure
Product Name:Ethanol,2-[(5-amino-2-methoxyphenyl)sulfonyl]-
CAS No:22094-96-8
MF:C9H13NO4S
MW:231.26882147789
CID:250434
PubChem ID:110153
Update Time:2025-04-19
Ethanol,2-[(5-amino-2-methoxyphenyl)sulfonyl]- Chemical and Physical Properties
Names and Identifiers
-
- Ethanol,2-[(5-amino-2-methoxyphenyl)sulfonyl]-
- 2-(5-amino-2-methoxyphenyl)sulfonylethanol
- 3-[(2-Hydroxyethyl)sulfonyl]-4-methoxyaniline
- 4-Methoxy-3-(2-hydroxyethylsulfonyl)aniline
- 5-Amino-2-methoxyphenyl2-hydroxyethyl sulfone
- Ethanol,2-(6-methoxymetanilyl)- (8CI)
- 22094-96-8
- 2-(5-Amino-2-methoxybenzene-1-sulfonyl)ethan-1-ol
- SCHEMBL8165270
- DTXSID40276085
- 2-[(5-amino-2-methoxyphenyl)-sulfonyl]ethanol
-
- Inchi: 1S/C9H13NO4S/c1-14-8-3-2-7(10)6-9(8)15(12,13)5-4-11/h2-3,6,11H,4-5,10H2,1H3
- InChI Key: PPZPNXZSZRZLJY-UHFFFAOYSA-N
- SMILES: S(CCO)(C1C=C(C=CC=1OC)N)(=O)=O
Computed Properties
- Exact Mass: 231.05659
- Monoisotopic Mass: 231.057
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 285
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.3
- Topological Polar Surface Area: 98?2
Experimental Properties
- PSA: 89.62
Ethanol,2-[(5-amino-2-methoxyphenyl)sulfonyl]- Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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