Cas no 89846-90-2 (1-(Tert-butyldisulfanyl)-2,4-dinitrobenzene)
89846-90-2 structure
Product Name:1-(Tert-butyldisulfanyl)-2,4-dinitrobenzene
CAS No:89846-90-2
MF:C10H12N2O4S2
MW:288.343279838562
CID:993888
PubChem ID:262742
Update Time:2025-04-20
1-(Tert-butyldisulfanyl)-2,4-dinitrobenzene Chemical and Physical Properties
Names and Identifiers
-
- DTXSID901009020
- 89846-90-2
- 1-(tert-butyldisulfanyl)-2,4-dinitrobenzene
- NSC-96679
- NSC96679
- 1-(Tert-butyldisulfanyl)-2,4-dinitrobenzene
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- Inchi： 1S/C10H12N2O4S2/c1-10(2,3)18-17-9-5-4-7(11(13)14)6-8(9)12(15)16/h4-6H,1-3H3
- InChI Key： NIODFAXPOVQHFI-UHFFFAOYSA-N
- SMILES： S(C(C)(C)C)SC1C=CC(=CC=1[N+](=O)[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 288.024
- Monoisotopic Mass: 288.024
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 321
- 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: 3.1
- Topological Polar Surface Area: 142?2
Experimental Properties
- Density: 1.38
- Boiling Point: 389.2°C at 760 mmHg
- Flash Point: 189.2°C
- Refractive Index: 1.624
1-(Tert-butyldisulfanyl)-2,4-dinitrobenzene Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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