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名称

3-硝基-4-氨基苯酚

别名

4-羟基-2-硝基苯胺 | 4-氨基-3-硝基苯酚

英文别名

AC-16153 | 4-AMINO-3-NITROPHENOL [INCI] | IQXUIDYRTHQTET-UHFFFAOYSA- | NSC400380 | NSC-400380 | 3-NITRO-4-AMINO PHENOL | AKOS005151894 | Z431554226 | NSC 40038 | 4-Amino-3-nitrophenol | 4-amino-3-nitro-phenol | STR02932 | BP-20101 | A833037 | 3-Nitro-4-am

英文名称

4-Amino-3-nitrophenol

货号

A101335-100g

包装规格

100g

浓度

≥98%

运输条件

常规运输

产品介绍

溶于水，溶于甲醇、乙醇、异丙醇、丙酮、DMSO、氯仿、二氯甲烷、二甲苯、苯和乙醚。用途： 4-氨基-3-硝基苯酚被用于合成苯并咪唑类因子Xa（胰蛋白酶样丝氨酸蛋白酶）抑制剂和4-(4-氨基-3-硝基苯氧基)邻苯二甲腈。它还在可见基质辅助激光解吸/电离质谱分析中被用作基质。.

应用

4-Amino-3-nitrophenol was used in the synthesis of benzimidazole based Factor Xa (trypsin-like serine protease) inhibitors and 4-(4-amino-3-nitrophenoxy)phthalonitrile. It was also employed as matrix during visible matrix-assisted laser desorption/ionization mass spectrometry.

CAS号

610-81-1

分子式

C6H6N2O3

分子量

154.12 g/mol

Beilstein号

2210196

EC号

210-236-8

MDL号

MFCD00066310

PubChem编号

3758882

Isomeric SMILES

C1=CC(=C(C=C1O)[N+](=O)[O-])N

IIUPAC Name

4-amino-3-nitrophenol

INCHI

1S/C6H6N2O3/c7-5-2-1-4(9)3-6(5)8(10)11/h1-3,9H,7H2

InChi Key

IQXUIDYRTHQTET-UHFFFAOYSA-N

Smiles

C1=CC(=C(C=C1O)[N+](=O)[O-])N

PubChem SID

488194550

溶解性

Soluble in water. (1.8 g/L.)

熔点

150-154°C

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

154.038 Da

单同位素质量Monoisotopic Mass

154.038 Da

拓扑极表面积Topological Polar Surface Area

92.100 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

156.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

0.900

密度

1.511

Reaxy-Rn

2210196

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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