Cas no 100524-52-5 (Pseudourea,2,2'-(iminodiethylene)bis[2-thio-, trihydrobromide (6CI))
100524-52-5 structure
Product Name:Pseudourea,2,2'-(iminodiethylene)bis[2-thio-, trihydrobromide (6CI)
CAS No:100524-52-5
MF:C6H18Br3N5S2
MW:464.082615375519
CID:161113
PubChem ID:3063346
Update Time:2025-04-19
Pseudourea,2,2'-(iminodiethylene)bis[2-thio-, trihydrobromide (6CI) Chemical and Physical Properties
Names and Identifiers
-
- 2-(2-carbamimidoylsulfanylethylamino)ethyl carbamimidothioate,trihydrobromide
- 2-(2-carbamimidoylsulfanylethylamino)ethylsulfanylmethanimidamide trih ydrobromide
- 2,2'-(Iminodiethylene)bis(2-thiopseudourea) trihydrobromide
- iminodiethane-2,1-diyl bis(imidothiocarbamate) trihydrobromide
- Pseudourea, 2,2'-(iminodiethylene)bis(2-thio-, trihydrobromide
- S,2-Di(isothiuroniumethyl)amine dibromide hydrobromide
- 100524-52-5
- 2-(2-carbamimidoylsulfanylethylamino)ethyl carbamimidothioate;trihydrobromide
- DTXSID20143367
- Pseudourea,2,2'-(iminodiethylene)bis[2-thio-, trihydrobromide (6CI)
-
- Inchi： 1S/C6H15N5S2.3BrH/c7-5(8)12-3-1-11-2-4-13-6(9)10;;;/h11H,1-4H2,(H3,7,8)(H3,9,10);3*1H
- InChI Key： REUHSZZZJINFEQ-UHFFFAOYSA-N
- SMILES： Br.Br.Br.S(C(=N)N)CCNCCSC(=N)N
Computed Properties
- Exact Mass: 460.85554
- Monoisotopic Mass: 460.85538g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 8
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 8
- Complexity: 154
- Covalently-Bonded Unit Count: 4
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 162?2
Experimental Properties
- PSA: 111.77
Pseudourea,2,2'-(iminodiethylene)bis[2-thio-, trihydrobromide (6CI) Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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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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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
100524-52-5 (Pseudourea,2,2'-(iminodiethylene)bis[2-thio-, trihydrobromide (6CI)) Related Products
- 1779-81-3(2-aminothiazoline)
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- 2986-21-2(Carbamimidothioic acid,propyl ester)
- 13702-02-8(prop-2-ynylsulfanylmethanimidamide)
- 409314-85-8(Carbamimidothioic acid,2-(dimethylamino)-1-methylethyl ester)
- 121215-88-1(Methanamine,N-(3-methyl-2-thiazolidinylidene)-)
- 226989-45-3(Methanamine,N-(3-ethyl-2-thiazolidinylidene)-)
- 142620-95-9(Carbamimidothioic acid,2-[bis(1-methylethyl)amino]ethyl ester)
- 504-78-9(Thiazolidine)
- 17124-82-2(Carbamimidothioic acid,2-(dimethylamino)ethyl ester)
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