Cas no 68641-76-9 ( )
structure
Product Name:
CAS No:68641-76-9
MF:C18H24N2O6S2
MW:428.52296257019
CID:971686
PubChem ID:233520
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
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- N-ethyl-4-[2-[4-(ethylsulfamoyl)phenoxy]ethoxy]benzenesulfonamide
- 4,4'-Aethandiyldimercapto-di-phenol
- 4,4'-Aethandiyldioxy-bis-benzolsulfonsaeure-bis-aethylamid
- 4,4'-ethanediyldimercapto-di-phenol
- 4,4'-ethanediyldioxy-bis-benzenesulfonic acid bis-ethylamide
- AGN-PC-001RY2
- CTK0B2754
- Phenol, 4,4'-[1,2-ethanediylbis(thio)]bis-
- NSC32092
- 68641-76-9
- NSC-32092
- DTXSID30988327
- 4,4'-[Ethane-1,2-diylbis(oxy)]bis(N-ethylbenzene-1-sulfonamide)
-
-
- Inchi： 1S/C18H24N2O6S2/c1-3-19-27(21,22)17-9-5-15(6-10-17)25-13-14-26-16-7-11-18(12-8-16)28(23,24)20-4-2/h5-12,19-20H,3-4,13-14H2,1-2H3
- InChI Key： UCXJSLCDURTRIZ-UHFFFAOYSA-N
- SMILES： S(C1C=CC(=CC=1)OCCOC1C=CC(=CC=1)S(NCC)(=O)=O)(NCC)(=O)=O
Computed Properties
- Exact Mass: 428.10772
- Monoisotopic Mass: 428.10757884g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 28
- Rotatable Bond Count: 11
- Complexity: 583
- 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: 2.2
- Topological Polar Surface Area: 128?2
Experimental Properties
- PSA: 110.8
- LogP: 4.68420
Related Literature
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
-
Eunkyung Choi,Minjoo Ryu,Haeri Lee,Ok-Sang Jung Dalton Trans., 2017,46, 4595-4601
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