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Product details

名称

对硝基苯甲醇

分子类型

小分子

别名

4-硝基苯甲醇

英文别名

英文名称

4-Nitrobenzyl Alcohol

货号

N110318-1kg

包装规格

1kg

浓度

≥98%

运输条件

常规运输

产品介绍

有机合成中间体。

CAS号

619-73-8

分子式

C7H7NO3

分子量

153.14 g/mol

Beilstein号

1424026

EC号

210-611-6

MDL号

MFCD00007376

PubChem编号

69275

Isomeric SMILES

C1=CC(=CC=C1CO)[N+](=O)[O-]

IIUPAC Name

(4-nitrophenyl)methanol

INCHI

1S/C7H7NO3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4,9H,5H2

InChi Key

JKTYGPATCNUWKN-UHFFFAOYSA-N

Smiles

C1=CC(=CC=C1CO)[N+](=O)[O-]

PubChem SID

488184279

溶解性

Soluble in water (2 mg/ml at 20°C).

熔点

93-97°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

153.043 Da

单同位素质量Monoisotopic Mass

153.043 Da

拓扑极表面积Topological Polar Surface Area

66.100 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

135.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

1.300

闪点(℃)

180℃

沸点

185°C

Reaxy-Rn

1424026

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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