3,8-diamino-5-methyl-6-phenylphenanthridin-5-ium bromide

• ChemBase编号: 103213
• 分子式: C20H18BrN3
• 平均质量: 380.28102
• 单一同位素质量: 379.06840959
• SMILES: [Br-].C[n+]1c2cc(N)ccc2c2ccc(N)cc2c1c1ccccc1
• Canonical SMILES: Nc1ccc2c(c1)c(c1ccccc1)[n+](c1c2ccc(c1)N)C.[Br-]
• InChI: InChI=1S/C20H17N3.BrH/c1-23-19-12-15(22)8-10-17(19)16-9-7-14(21)11-18(16)20(23)13-5-3-2-4-6-13;/h2-12,22H,21H2,1H3;1H
• InChIKey: MQOKYEROIFEEBH-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 3,8-diamino-5-methyl-6-phenylphenanthridin-5-ium bromide
• IUPAC传统名: 3,8-diamino-5-methyl-6-phenylphenanthridin-5-ium bromide
• 别名: 3,8-二氨基-5-甲基-6-苯基溴化菲啶鎓盐; 3,8-Diamino-5-methyl-6-phenylphenanthridinium bromide; Dimidium bromide; 3,8-Diamino-5-methyl-6-phenyl-phenanthridinium bromide; Trypadine; DIMIDIUM BROMIDE

登记号

• CAS号: 518-67-2
• EC号: 208-256-7
• MDL号: MFCD00011757
• Beilstein号: 3809779
• PubChem SID: 24893294; 24854036; 24866185; 162090635
• PubChem CID: 68207

理论计算性质

• 质子受体: 2
• 质子供体: 2
• LogD (pH = 5.5): -1.275742
• LogD (pH = 7.4): -1.2701377
• Log P: -1.2700658
• 摩尔折射率: 97.2489 cm^3
• 极化性: 40.02613 Å^3
• 极化表面积: 55.92 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

• 熔点: 230°C (decomposes); 230°C dec.; 243-248 °C(lit.)
• 荧光: λex 306 nm; λem 612 nm in 50 mM Tris pH 8.0 (DNA); λex 480 (pH 7.6, low ionic strength)

安全信息

• 保存条件: Room Temperature (15-30°C)
• RTECS编号: SF7960500
• 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: 26-36; 26-37
• TSCA收录: 否
• 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; P261-P305+P351+P338-P302+P352-P321-P405-P501A
• 个人保护装置: dust mask type N95 (US), Eyeshields, Gloves
• 保存温度: 2-8°C

产品相关信息

• 纯度: ~95%; ~95% (AT); ≥95%; 95%
• 适用性: suitable for fluorescence
• 产品线: BioReagent
• Empirical Formula (Hill Notation): C20H18BrN3

详细说明

MP Biomedicals - 02150958

Purity: ~95%
Fluorescent probe for nucleic acids; interchelating agent

Sigma Aldrich - 41785

Application
Intercalating probe for nucleic acids.1
包装
1 g in glass bottle
250 mg in glass bottle

Sigma Aldrich - D0773

Application
Intercalating probe for nucleic acids.1

Sigma Aldrich - 234281

Application
Intercalating probe for nucleic acids.1