disodium 3-[(4-chloro-2-methylphenyl)carbamoyl]naphthalen-2-yl phosphate

• ChemBase编号: 132579
• 分子式: C18H13ClNNa2O5P
• 平均质量: 435.705821
• 单一同位素质量: 435.00152539
• SMILES: Cc1cc(ccc1NC(=O)c1cc2ccccc2cc1OP(=O)([O-])[O-])Cl.[Na+].[Na+]
• Canonical SMILES: Clc1ccc(c(c1)C)NC(=O)c1cc2ccccc2cc1OP(=O)([O-])[O-].[Na+].[Na+]
• InChI: InChI=1S/C18H15ClNO5P.2Na/c1-11-8-14(19)6-7-16(11)20-18(21)15-9-12-4-2-3-5-13(12)10-17(15)25-26(22,23)24;;/h2-10H,1H3,(H,20,21)(H2,22,23,24);;/q;2*+1/p-2
• InChIKey: TYCHZTPSWMGRRI-UHFFFAOYSA-L

名称和登记号

名称

• IUPAC标准名: disodium 3-[(4-chloro-2-methylphenyl)carbamoyl]naphthalen-2-yl phosphate
• IUPAC传统名: disodium 3-[(4-chloro-2-methylphenyl)carbamoyl]naphthalen-2-yl phosphate
• 别名: Naphthol AS-TR phosphate disodium salt

登记号

• CAS号: 4264-93-1
• MDL号: MFCD00069550
• PubChem SID: 162226856; 24897683; 24897766
• PubChem CID: 16219747

理论计算性质

• Acid pKa: 1.7435989
• 质子受体: 4
• 质子供体: 1
• LogD (pH = 5.5): 1.8302045
• LogD (pH = 7.4): 1.0790049
• Log P: 4.214643
• 摩尔折射率: 98.4981 cm^3
• 极化性: 38.7134 Å^3
• 极化表面积: 101.52 Å^2
• 可自由旋转的化学键: 4
• 里宾斯基五规则: true

分子性质

理化性质

• 外观: tablet

安全信息

• 德国WGK号: 3
• 个人保护装置: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
• 保存温度: -20°C

产品相关信息

• 纯度: ≥99% (HPLC)
• 产品质量级别: PREMIUM

详细说明

Sigma Aldrich - N6125

Application
Substrate for the histochemical demonstration of acid and alkaline phosphatase.

Sigma Aldrich - N8518

Application
Substrate for the histochemical demonstration of acid and alkaline phosphatase.
Specificity
Naphthol AS-TR Phosphate is a substrate for use with alkaline phosphatase in immunoblotting and immunohistological staining procedures. When Naphthol AS-TR Phosphate is used in conjunction with Fast Red RC Tablets (Sigma Product No. F 5146) an insoluble end product is produced that is red in color and can be observed visually. Naphthol AS-TR Phosphate Tablets may also be used with other coupling salts in other applications.