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Product details

名称

6-溴吡啶甲酸

分子类型

小分子

英文别名

6-Bromopyridine-2-carboxylic acid | 6-Bromopicolinic Acid | 6-Bromo-2-pyridinecarboxylic Acid

英文名称

6-Bromopicolinic Acid

货号

B684505-1g

包装规格

浓度

≥97%

运输条件

常规运输

产品介绍

用于合成手性 2,2′-二吡啶基胺。

CAS号

21190-87-4

分子式

C6H4BrNO2

分子量

202.01 g/mol

Beilstein号

22(5)2,48

MDL号

MFCD00093197

PubChem编号

593919

Isomeric SMILES

C1=CC(=NC(=C1)Br)C(=O)O

IIUPAC Name

6-bromopyridine-2-carboxylic acid

INCHI

1S/C6H4BrNO2/c7-5-3-1-2-4(8-5)6(9)10/h1-3H,(H,9,10)

InChi Key

XURXQNUIGWHWHU-UHFFFAOYSA-N

Smiles

C1=CC(=NC(=C1)Br)C(=O)O

熔点

192-194°C(lit.)

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

200.943 Da

单同位素质量Monoisotopic Mass

200.943 Da

拓扑极表面积Topological Polar Surface Area

50.200 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

140.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

1.700

Reaxy-Rn

115853

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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