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名称

2-羟基喹啉-4-羧酸

分子类型

小分子

英文别名

Cinchocaine Hydrochloride Imp. B (EP): 2-Hydroxyquinoline-4- | FT-0612590 | AM20070290 | BBL008901 | D78174 | SR-01000597059 | IFLab1_001493 | Acetamide,2-cyano-N-[3-(trifluoromethyl)phenyl]- | Z1Q2K479UQ | NSC 625453 | SCHEMBL662652 | Enamine_001230 | NS

英文名称

2-Hydroxyquinoline-4-carboxylic acid

货号

H469739-100g

包装规格

100g

浓度

≥97%

储存温度

2-8°C储存

运输条件

冰袋运输

CAS号

84906-81-0

分子式

C10H7NO3

分子量

189.17 g/mol

MDL号

MFCD00023942

PubChem编号

85076

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=O)N2)C(=O)O

IIUPAC Name

2-oxo-1H-quinoline-4-carboxylic acid

INCHI

1S/C10H7NO3/c12-9-5-7(10(13)14)6-3-1-2-4-8(6)11-9/h1-5H,(H,11,12)(H,13,14)

InChi Key

MFSHNFBQNVGXJX-UHFFFAOYSA-N

Smiles

C1=CC=C2C(=C1)C(=CC(=O)N2)C(=O)O

熔点

>300℃

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

189.043 Da

单同位素质量Monoisotopic Mass

189.043 Da

拓扑极表面积Topological Polar Surface Area

66.400 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

308.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

0.600

闪点(℃)

Not applicable

Reaxy-Rn

154678

RIDADR

NONH for all modes of transport

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

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「No related articles yet」

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