1. Primary Information
| English name: | Nitroblue tetrazolium chloride |
| CAS No.: | 298-83-9 |
| Molecular formula: | C40H30Cl2N10O6 |
| Molecular weight: | 817.6 g/mol |
| SMILES: | COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5)OC)[N+]6=NC(=NN6C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=CC=C8.[Cl-].[Cl-] |
| Structural class: | |
| Other identifiers: |
Blue, Nitrotetrazolium Nitro-BT Nitroblue Tetrazolium Nitroblue, Tetrazolium Nitrotetrazolium Blue |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 250mg | BR，98% | 56 | 2-8℃,避光 | in stock | - |
| Kehua Intelligence | 1g | BR，98% | 160 | 2-8℃,避光 | in stock | - |
| Kehua Intelligence | 5g | BR，98% | 492 | 2-8℃,避光 | in stock | - |
| Kehua Intelligence | 25g | BR，98% | 1592 | 2-8℃,避光 | in stock | - |
| Kehua Intelligence | 100g | BR，98% | 6080 | 2-8℃,避光 | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
2-[2-methoxy-4-[3-methoxy-4-[3-(4-nitrophenyl)-5-phenyltetrazol-2-ium-2-yl]phenyl]phenyl]-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium;dichloride
4.2 InChI
InChI=1S/C40H30N10O6.2ClH/c1-55-37-25-29(13-23-35(37)47-43-39(27-9-5-3-6-10-27)41-45(47)31-15-19-33(20-16-31)49(51)52)30-14-24-36(38(26-30)56-2)48-44-40(28-11-7-4-8-12-28)42-46(48)32-17-21-34(22-18-32)50(53)54;;/h3-26H,1-2H3;2*1H/q+2;;/p-2
4.3 InChIKey
FSVCQIDHPKZJSO-UHFFFAOYSA-L
4.4 Canonical SMILES
COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5)OC)[N+]6=NC(=NN6C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=CC=C8.[Cl-].[Cl-]
4.5 Isomeric SMILES
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