4-hydroxy-7,8-dimethyl-10-(2,3,4,5-tetrahydroxypentyl)-2H,10H-benzo[g]pteridin-2-one

• ChemBase编号: 105844
• 分子式: C17H20N4O6
• 平均质量: 376.3639
• 单一同位素质量: 376.13828438
• SMILES: Cc1cc2c(cc1C)n(CC(O)C(O)C(O)CO)c1nc(=O)nc(O)c1n2
• Canonical SMILES: OCC(C(C(Cn1c2cc(C)c(cc2nc2c1nc(=O)nc2O)C)O)O)O
• InChI: InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)
• InChIKey: AUNGANRZJHBGPY-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 4-hydroxy-7,8-dimethyl-10-(2,3,4,5-tetrahydroxypentyl)-2H,10H-benzo[g]pteridin-2-one
• IUPAC传统名: 4-hydroxy-7,8-dimethyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-2-one
• 别名: Vitamin B₂; Lactoflavin; Vitamin G; RIBOFLAVIN

登记号

• CAS号: 83-88-5
• EC号: 201-507-1
• PubChem SID: 162094215
• PubChem CID: 1072

理论计算性质

• Acid pKa: 6.107119
• 质子受体: 10
• 质子供体: 5
• LogD (pH = 5.5): -0.7586639
• LogD (pH = 7.4): -2.2443652
• Log P: -0.5490395
• 摩尔折射率: 96.590096 cm^3
• 极化性: 35.44932 Å^3
• 极化表面积: 158.54 Å^2
• 可自由旋转的化学键: 5
• 里宾斯基五规则: true

分子性质

理化性质

• 熔点: 282°C

安全信息

• 保存条件: Room Temperature (15-30°C)
• RTECS编号: VJ1400000
• 欧盟危险性物质标志: 刺激性(Irritant) (Xi)
• 危险公开号: R:36/37/38
• 安全公开号: S:20-25-26-37/39

产品相关信息

• 纯度: >98%; 98%

详细说明

MP Biomedicals - 04800033

Purity: >98%
Photoinitiator for polymerization of polyacrylamide gels. Causes less denaturing than other initiators. Gel strength can be improved when used with PTO.

MP Biomedicals - 04800029

Purity: >98%
Photoinitiator for polymerization of polyacrylamide gels. Causes less denaturing than other initiators. Gel strength can be improved when used with PTO.

MP Biomedicals - 02194735

Cell Culture Reagent
Crystalline
Purity: 98%