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255825-38-8

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Basic Information
CAS No.: 255825-38-8
Name: 2-(1-Oxy-pyridin-2-yl)-1,1,3,3-tetramethylisothiouronium tetrafluoroborate
Molecular Structure:
Molecular Structure of 255825-38-8 (2-(1-Oxy-pyridin-2-yl)-1,1,3,3-tetramethylisothiouronium tetrafluoroborate)
Formula: C10H16BF4N3OS
Molecular Weight: 313.13
Synonyms: TOTT, 2-(1-Oxy-pyridin-2-yl)-1,1,3,3-tetramethylisothiouronium tetrafluoroborate;
Melting Point: 111-116 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26
PSA: 57.01000
LogP: 2.69690
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    Product Name: 2-(1-Oxy-pyridin-2-yl)-1,1,3,3-tetramethylisothiouronium tetrafluoroborate Synonyms: 2-(1-OXY-PYRIDIN-2-YL)-1,1,3,3-TETRAMETHYLISOTHIOURONIUM TETRAFLUOROBORATE;S-(1-OXO-2-PYRIDYL)-THIO-N,N,N',N'-TETRAMETHYLURONIUM

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Specification

This chemical is called 2-(1-Oxy-pyridin-2-yl)-1,1,3,3-tetramethylisothiouronium tetrafluoroborate, and its systematic name is N-{(dimethylamino)[(1-oxidopyridin-2-yl)sulfanyl]methylidene}-N-methylmethanaminium tetrafluoroborate. With the molecular formula of C10H16BF4N3OS, its molecular weight is 313.13. The CAS registry number of this chemical is 255825-38-8, and its product category is Coupling Reagent. In addition, this chemical should be stored at the temperature of −20°C.

Other characteristics of the 2-(1-Oxy-pyridin-2-yl)-1,1,3,3-tetramethylisothiouronium tetrafluoroborate can be summarised as followings: (1)#H bond acceptors: 4; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 55.66 Å2.

You can still convert the following datas into molecular structure: 
1.SMILES: F[B-](F)(F)F.[O-][n+]1ccccc1S/C(N(C)C)=[N+](/C)C
2.InChI: InChI=1/C10H16N3OS.BF4/c1-11(2)10(12(3)4)15-9-7-5-6-8-13(9)14;2-1(3,4)5/h5-8H,1-4H3;/q+1;-1
3.InChIKey: LHLFXDQURZVFLK-UHFFFAOYAK
4.Std. InChI: InChI=1S/C10H16N3OS.BF4/c1-11(2)10(12(3)4)15-9-7-5-6-8-13(9)14;2-1(3,4)5/h5-8H,1-4H3;/q+1;-1
5.Std. InChIKey: LHLFXDQURZVFLK-UHFFFAOYSA-N