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名称

2-氯-4-羟基苯甲腈

英文别名

英文名称

2-Chloro-4-hydroxybenzonitrile

货号

C123974-100g

包装规格

100g

浓度

≥98%

运输条件

常规运输

产品介绍

It may be used in the synthesis of 6-aminophenanthridines via Suzuki-Miyaura coupling reaction,and also used in the preparation of 5-bromo-2-chloro-4-hydroxybenzonitrile. It may be used in the synthesis of 6-aminophenanthridines via Suzuki-Miyaura coupling reaction,and also used in the preparation of 5-bromo-2-chloro-4-hydroxybenzonitrile.

CAS号

3336-16-1

分子式

ClC6H3(OH)CN

分子量

153.57 g/mol

MDL号

MFCD00052185

PubChem编号

592797

Isomeric SMILES

C1=CC(=C(C=C1O)Cl)C#N

IIUPAC Name

2-chloro-4-hydroxybenzonitrile

INCHI

1S/C7H4ClNO/c8-7-3-6(10)2-1-5(7)4-9/h1-3,10H

InChi Key

BDDVAWDNVWLHDQ-UHFFFAOYSA-N

Smiles

C1=CC(=C(C=C1O)Cl)C#N

PubChem SID

488190538

熔点

160°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

152.998 Da

单同位素质量Monoisotopic Mass

152.998 Da

拓扑极表面积Topological Polar Surface Area

44.000 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

162.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

2.400

Reaxy-Rn

2936426

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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