Cas no 100866-99-7 (1-[4-(4-aminophenyl)sulfonylphenyl]ethanone)
100866-99-7 structure
Product Name:1-[4-(4-aminophenyl)sulfonylphenyl]ethanone
CAS No:100866-99-7
MF:C14H13NO3S
MW:275.322922468185
CID:1129839
PubChem ID:23275166
Update Time:2025-04-20
1-[4-(4-aminophenyl)sulfonylphenyl]ethanone Chemical and Physical Properties
Names and Identifiers
-
- 1-[4-(4-aminophenyl)sulfonylphenyl]ethanone
- Ethanone, 1-[4-[(4-aminophenyl)sulfonyl]phenyl]-
- 1-(4-Sulfanilyl-phenyl)-aethanon
- 1-(4-sulfanilyl-phenyl)-ethanone
- 4'-(4-aminophenylsulphonyl)acetophenone
- CHEMBL143296
- ACMC-1BRYA
- CTK0G8594
- 1-[4-[(4-Aminophenyl)sulfonyl]phenyl]ethanone
- DTXSID00632340
- 1-[4-(4-Aminobenzene-1-sulfonyl)phenyl]ethan-1-one
- 100866-99-7
-
- Inchi: 1S/C14H13NO3S/c1-10(16)11-2-6-13(7-3-11)19(17,18)14-8-4-12(15)5-9-14/h2-9H,15H2,1H3
- InChI Key: HGWHPLHKHGKPKK-UHFFFAOYSA-N
- SMILES: S(C1C=CC(=CC=1)N)(C1C=CC(C(C)=O)=CC=1)(=O)=O
Computed Properties
- Exact Mass: 275.06169
- Monoisotopic Mass: 275.06161445g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 411
- 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: 1.7
- Topological Polar Surface Area: 85.6?2
Experimental Properties
- PSA: 77.23
1-[4-(4-aminophenyl)sulfonylphenyl]ethanone Related Literature
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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