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Product details

名称

2′,6′-二羟基苯乙酮

分子类型

小分子

别名

2-乙酰间苯二酚 | 2-乙酰-1,3-二羟基苯

英文别名

英文名称

2′,6′-Dihydroxyacetophenone

货号

D113511-10g

包装规格

10g

浓度

≥99%

运输条件

常规运输

产品介绍

溶于水和醇。

应用

用作有机合成中间体，药物色甘酸钠的原料。

CAS号

699-83-2

分子式

C8H8O3

分子量

152.15 g/mol

Beilstein号

1366061

EC号

211-833-6

MDL号

MFCD00002270

PubChem编号

69687

Isomeric SMILES

CC(=O)C1=C(C=CC=C1O)O

IIUPAC Name

1-(2,6-dihydroxyphenyl)ethanone

INCHI

1S/C8H8O3/c1-5(9)8-6(10)3-2-4-7(8)11/h2-4,10-11H,1H3

InChi Key

YPTJKHVBDCRKNF-UHFFFAOYSA-N

Smiles

CC(=O)C1=C(C=CC=C1O)O

PubChem SID

488184385

熔点

155-156°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

152.047 Da

单同位素质量Monoisotopic Mass

152.047 Da

拓扑极表面积Topological Polar Surface Area

57.500 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

145.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

1.400

密度

1.291

Reaxy-Rn

1366061

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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