({6-bromo-3-[(2-methoxyphenyl)carbamoyl]naphthalen-2-yl}oxy)phosphonic acid

• ChemBase编号: 102637
• 分子式: C18H15BrNO6P
• 平均质量: 452.192561
• 单一同位素质量: 450.98203584
• SMILES: COc1c(NC(=O)c2c(OP(=O)(O)O)cc3ccc(Br)cc3c2)cccc1
• Canonical SMILES: COc1ccccc1NC(=O)c1cc2cc(Br)ccc2cc1OP(=O)(O)O
• InChI: InChI=1S/C18H15BrNO6P/c1-25-16-5-3-2-4-15(16)20-18(21)14-9-12-8-13(19)7-6-11(12)10-17(14)26-27(22,23)24/h2-10H,1H3,(H,20,21)(H2,22,23,24)
• InChIKey: HUXIAXQSTATULQ-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: ({6-bromo-3-[(2-methoxyphenyl)carbamoyl]naphthalen-2-yl}oxy)phosphonic acid
• IUPAC传统名: {6-bromo-3-[(2-methoxyphenyl)carbamoyl]naphthalen-2-yl}oxyphosphonic acid
• 别名: Naphthol AS-BI phosphate; 7-Bromo-3-hydroxy-2-naphthoic-o-anisidide phosphate; NAPHTHOL AS-BI PHOSPHATE; Naphthol AS-BI Phosphoric acid solution; Naphthol AS-BI Phosphoric acid solution; Naphthol AS-BI Phosphoric Acid

登记号

• CAS号: 1919-91-1
• EC号: 217-645-0; 231-791-2
• MDL号: MFCD00004058
• Beilstein号: 6668526
• PubChem SID: 24850853; 24864118; 162088162; 24864087; 24897552
• PubChem CID: 74715

理论计算性质

• Acid pKa: 1.7435911
• 质子受体: 5
• 质子供体: 3
• LogD (pH = 5.5): 1.3238173
• LogD (pH = 7.4): 0.57248515
• Log P: 3.7082582
• 摩尔折射率: 104.9815 cm^3
• 极化性: 40.66261 Å^3
• 极化表面积: 105.09 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

• 闪点: 136.4 °F; 36 °C; 58 °C; 96.8 °F

安全信息

• 保存条件: 0°C
• 欧盟危险性物质标志: 有毒(Toxic) (T); 刺激性(Irritant) (Xi)
• 联合国危险货物编号: 1993; 2265
• 德国WGK号: 2; 3
• 联合国危险货物等级: 3
• 联合国危险货物包装类别(PG): 3
• 危险公开号: 10-20/21/22-39/23/24/25; 36/37/38; 61-20/21-36
• 安全公开号: 26-36; 36/37; 53-26-36/37-45
• GHS危险品标识: GHS02; GHS05; GHS07; GHS08
• GHS警示词: Danger; Warning
• GHS危险声明: H226-H302 + H312 + H332-H318-H370; H226-H312 + H332-H319-H360D; H315-H319-H335
• GHS警示性声明: P201-P280-P305 + P351 + P338-P308 + P313; P260-P280-P305 + P351 + P338-P307 + P311; P261-P305 + P351 + P338
• 个人保护装置: dust mask type N95 (US), Eyeshields, Gloves; Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1993 3/PG 3; UN 2265 3/PG 3
• 保存温度: -20°C; 2-8°C

产品相关信息

• 纯度: ≥95.0% (HPLC); 98%
• 级别: for histology
• 临床用途: for in vitro diagnostic use
• 有效期: (Expiry date on the label.)
• 产品质量级别: IVD
• Empirical Formula (Hill Notation): C18H15BrNO6P

详细说明

MP Biomedicals - 02102415

Substrate for assay of acid phosphatase by flow cytometry.

Sigma Aldrich - 1802

Components
Napthol AS-BI phosphoric Acid, 4 g/L, in methanol solution with stabilizers.
Application
For use in the Sigma Lymphocyte Enzyme (Acid Phosphatase) Procedure, No. 181A

Sigma Aldrich - 3864

Components
Napthol AS-BI phosphoric acid, 12.5 mg/mL in N,N-dimethyl formamide.
Application
For use in Sigma Acid Phosphatase Procedure No. 386.

Sigma Aldrich - 3871

Components
Napthol AS-BI phosphoric acid, 12.5 mg/mL.
Application
For use in the Sigma Acid Phosphatase (TRAP) Procedure, Kit 387A

Sigma Aldrich - 229377

Application
Substrate for the histochemical demonstration of acid and alkaline phosphatase. Substrate for the fluorometric assay of acid and alkaline phosphatases.1 Demonstration of acid phosphatase in paraffin embedded tissue.2 Cytofluorometric assay of acid phosphatase in single living cells.3
Substrates
Substrate for the histochemical demonstration of acid and alkaline phosphatase.

Sigma Aldrich - 70482

Application
Substrate for the histochemical demonstration of acid and alkaline phosphatase. Substrate for the fluorometric assay of acid and alkaline phosphatases.1 Demonstration of acid phosphatase in paraffin embedded tissue.2 Cytofluorometric assay of acid phosphatase in single living cells.3
Substrates
Substrate for the histochemical demonstration of acid and alkaline phosphatase.

Sigma Aldrich - N2125

Application
Substrate for the histochemical demonstration of acid and alkaline phosphatase. Substrate for the fluorometric assay of acid and alkaline phosphatases.1 Demonstration of acid phosphatase in paraffin embedded tissue.2 Cytofluorometric assay of acid phosphatase in single living cells.3
Substrates
Substrate for the histochemical demonstration of acid and alkaline phosphatase.