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CAS No.: | 1096-80-6 |
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Name: | 2,3,5-TRIPHENYLTETRAZOLIUM BROMIDE |
Molecular Structure: | |
Formula: | C19H15BrN4 |
Molecular Weight: | 379.259 |
Synonyms: | 2,3,5-Triphenyl-2H-tetrazol-3-ium bromide; |
EINECS: | 214-144-9 |
Melting Point: | 206-209?°C |
Boiling Point: | 210?°C(lit.) |
Flash Point: | 150?°F |
Hazard Symbols: | F,Xi |
Risk Codes: | 22-36/37/38 |
Safety: | 26-36 |
PSA: | 34.59000 |
LogP: | 0.21500 |
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The 2H-Tetrazolium,2,3,5-triphenyl-, bromide (1:1), with the CAS registry number of 1096-80-6, is also known as 2,3,5-Triphenyl-2H-tetrazol-3-ium bromide. It belongs to the product categories of Tetrazolium Salts; Tetrazolium Salts & Formazans. Its EINECS registry number is 214-144-9. Its molecular formula is C19H15BrN4 and molecular weight is 379.25. What's more, its IUPAC name is 2,3,5-Triphenyltetrazol-2-ium bromide.
Physical properties about the 2H-Tetrazolium,2,3,5-triphenyl-, bromide (1:1) are: (1)#H bond acceptors: 4; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 34.59 Å2.
You can still convert the following datas into molecular structure:
(1) SMILES: [Br-].n2[n+](c1ccccc1)n(nc2c3ccccc3)c4ccccc4
(2) InChI: InChI=1/C19H15N4.BrH/c1-4-10-16(11-5-1)19-20-22(17-12-6-2-7-13-17)23(21-19)18-14-8-3-9-15-18;/h1-15H;1H/q+1;/p-1
(3) InChIKey: YZSUTKMFUHJPNB-REWHXWOFAH