Cas no 40229-51-4 (Thioimidodicarbonic diamide ([(H2N)C(S)]2NH), N,N,2-trimethyl- (9CI))
![Thioimidodicarbonic diamide ([(H2N)C(S)]2NH), N,N,2-trimethyl- (9CI) structure](https://ossimg.kuujia.com/scimg/40500/40229-51-4x500.png)
40229-51-4 structure
Product Name:Thioimidodicarbonic diamide ([(H2N)C(S)]2NH), N,N,2-trimethyl- (9CI)
CAS No:40229-51-4
MF:C5H11N3S2
MW:177.290937662125
CID:326691
Update Time:2023-11-19
Thioimidodicarbonic diamide ([(H2N)C(S)]2NH), N,N,2-trimethyl- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Thioimidodicarbonicdiamide ([(H2N)C(S)]2NH), N,N,2-trimethyl-
- Thioimidodicarbonic diamide ([(H2N)C(S)]2NH), N,N,2-trimethyl- (9CI)
- 1,1,3-Trimethyl-2,4-dithiobiuret
- CID 119096309
- Thioimidodicarbonic diamide ([(H2N)C(S)]2NH), N,N,2-trimethyl- (9CI)
- Thioimidodicarbonic diamide ([(H2N)C(S)]2NH), N,N,2-trimethyl-
-
- Inchi： 1S/C5H11N3S2/c1-7(2)5(10)8(3)4(6)9/h1-3H3,(H2,6,9)
- InChI Key： UUJDXGACOOKDJU-UHFFFAOYSA-N
- SMILES： S=C(N(C(N)=S)C)N(C)C
Computed Properties
- Exact Mass: 177.039
- Monoisotopic Mass: 177.039
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 155
- 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
- Topological Polar Surface Area: 96.7
Experimental Properties
- Density: 1.273±0.06 g/cm3(Predicted)
- Boiling Point: 244.2±23.0 °C(Predicted)
- pka: 12.39±0.29(Predicted)
Thioimidodicarbonic diamide ([(H2N)C(S)]2NH), N,N,2-trimethyl- (9CI) Related Literature
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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