Cas no 71400-32-3 (Acetamide, N,N'-2,7-thianthrenediylbis-)
71400-32-3 structure
Product Name:Acetamide, N,N'-2,7-thianthrenediylbis-
CAS No:71400-32-3
MF:C16H14N2O2S2
MW:330.424561023712
CID:545596
PubChem ID:13215772
Update Time:2025-04-19
Acetamide, N,N'-2,7-thianthrenediylbis- Chemical and Physical Properties
Names and Identifiers
-
- Acetamide, N,N'-2,7-thianthrenediylbis-
- N-(7-acetamidothianthren-2-yl)acetamide
- DTXSID20528877
- 71400-32-3
- LFXHWTQSXLUAEH-UHFFFAOYSA-N
- 2,7-bis(acetylamino)thianthrene
- N,N'-(Thianthrene-2,7-diyl)diacetamide
- SCHEMBL2386891
-
- Inchi： 1S/C16H14N2O2S2/c1-9(19)17-11-3-5-13-15(7-11)21-14-6-4-12(18-10(2)20)8-16(14)22-13/h3-8H,1-2H3,(H,17,19)(H,18,20)
- InChI Key： LFXHWTQSXLUAEH-UHFFFAOYSA-N
- SMILES： S1C2C=CC(=CC=2SC2C=CC(=CC1=2)NC(C)=O)NC(C)=O
Computed Properties
- Exact Mass: 330.04982
- Monoisotopic Mass: 330.04967004g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 406
- 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: 2.5
- Topological Polar Surface Area: 109?2
Experimental Properties
- PSA: 58.2
Acetamide, N,N'-2,7-thianthrenediylbis- Related Literature
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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