5-methylphenazin-5-ium methyl sulfate

• ChemBase编号: 102282
• 分子式: C14H14N2O4S
• 平均质量: 306.33696
• 单一同位素质量: 306.06742794
• SMILES: COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc12
• Canonical SMILES: C[n+]1c2ccccc2nc2c1cccc2.COS(=O)(=O)[O-]
• InChI: InChI=1S/C13H11N2.CH4O4S/c1-15-12-8-4-2-6-10(12)14-11-7-3-5-9-13(11)15;1-5-6(2,3)4/h2-9H,1H3;1H3,(H,2,3,4)/q+1;/p-1
• InChIKey: RXGJTUSBYWCRBK-UHFFFAOYSA-M

名称和登记号

名称

• IUPAC标准名: 5-methylphenazin-5-ium methyl sulfate
• IUPAC传统名: 5-methylphenazin-5-ium monomethyl sulfate; 5-methylphenazin-5-ium methyl sulfate(1-)
• 别名: 5-甲基吩嗪硫酸甲酯; N-甲基吩嗪甲基硫酸盐; 吩嗪硫酸甲酯; Phenazine methosulfate; 5-Methylphenazinium methyl sulfate; N-Methylphenazonium methyl sulfate; PMS; PHENAZINE METHOSULFATE; N-Methyldibenzylpyrazine methyl sulfate salt; METHYLPHENAZONIUM METHOSULFATE

登记号

• CAS号: 299-11-6
• EC号: 206-072-1
• MDL号: MFCD00011923
• Beilstein号: 3898869
• PubChem SID: 24899045; 162089979
• PubChem CID: 9285

理论计算性质

• 质子受体: 1
• 质子供体: 0
• LogD (pH = 5.5): -1.5960132
• LogD (pH = 7.4): -1.596011
• Log P: -1.596011
• 摩尔折射率: 59.811 cm^3
• 极化性: 25.787004 Å^3
• 极化表面积: 16.77 Å^2
• 可自由旋转的化学键: 1
• 里宾斯基五规则: true

分子性质

理化性质

• 溶解度: H2O: soluble0.2 g/mL at 20 °C, clear, deep orange
• 熔点: 155-157°C (dec.); 158-160 °C (dec.)(lit.)
• 紫外吸收波长: λmax 386 nm

安全信息

• 保存条件: 2-8°C, Protect from light
• RTECS编号: SG1645000
• 欧盟危险性物质标志: 刺激性(Irritant) (Xi)
• 德国WGK号: 3
• 危险公开号: 36/37/38
• 安全公开号: 26
• GHS危险品标识: GHS07
• GHS警示词: Warning
• GHS危险声明: H315-H319-H335
• GHS警示性声明: P261-P305 + P351 + P338
• 个人保护装置: dust mask type N95 (US), Eyeshields, Gloves
• 保存温度: -20°C; 2-8°C

产品相关信息

• 纯度: ≥90% (UV); ≥96.0% (N); 98%
• 燃烧残渣: ≤0.1%
• 干燥失重: ≤1% loss on drying
• 线性分子式: C13H11N2 · CH3SO4

详细说明

MP Biomedicals - 02100955

Yellow crystals
Used in tyrosine transaminase test and for enzymic determination of ethanol in blood by the colorimetric micromethod.

MP Biomedicals - 05216619

MP Biomedicals Rare Chemical collection

MP Biomedicals - 02194595

Cell Culture Reagent
Yellow crystals
Used in tyrosine transaminase test and for enzymic determination of ethanol in blood by the colorimetric micromethod.

Sigma Aldrich - P9625

Application
Used with ascorbic acid to determine nitric oxide reductase activity.
包装
1, 5, 10, 25 g in glass bottle
500 mg in glass bottle

Sigma Aldrich - 68600

Other Notes
Electron acceptor in dye-linked enzyme assays1,2