Cas no 494201-78-4 (Benzenesulfonamide, 3-amino-N,N-diethyl-4-mercapto-)
494201-78-4 structure
Product Name:Benzenesulfonamide, 3-amino-N,N-diethyl-4-mercapto-
CAS No:494201-78-4
MF:C10H16N2O2S2
MW:260.376239776611
CID:1520318
Update Time:2024-08-23
Benzenesulfonamide, 3-amino-N,N-diethyl-4-mercapto- Chemical and Physical Properties
Names and Identifiers
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- Benzenesulfonamide, 3-amino-N,N-diethyl-4-mercapto-
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- Inchi： 1S/C10H16N2O2S2/c1-3-12(4-2)16(13,14)8-5-6-10(15)9(11)7-8/h5-7,15H,3-4,11H2,1-2H3
- InChI Key： COEDWDDWCXNLSN-UHFFFAOYSA-N
- SMILES： C1(S(N(CC)CC)(=O)=O)=CC=C(S)C(N)=C1
Computed Properties
- Exact Mass: 260.06548
Experimental Properties
- Density: 1.283±0.06 g/cm3(Predicted)
- Boiling Point: 421.2±55.0 °C(Predicted)
- PSA: 63.4
- pka: 7.10±0.11(Predicted)
Benzenesulfonamide, 3-amino-N,N-diethyl-4-mercapto- Related Literature
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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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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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