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Product details

名称

5,6-二甲氧基烟酸

英文别名

英文名称

5,6-Dimethoxynicotinic acid

货号

D186483-1g

包装规格

浓度

≥97%

储存温度

室温

运输条件

常规运输

CAS号

76470-34-3

分子式

C8H9NO4

分子量

183.2 g/mol

MDL号

D186483

PubChem编号

12563086

Isomeric SMILES

COC1=C(N=CC(=C1)C(=O)O)OC

IIUPAC Name

5,6-dimethoxypyridine-3-carboxylic acid

INCHI

1S/C8H9NO4/c1-12-6-3-5(8(10)11)4-9-7(6)13-2/h3-4H,1-2H3,(H,10,11)

InChi Key

DVPUSKADCOGLKP-UHFFFAOYSA-N

Smiles

COC1=C(N=CC(=C1)C(=O)O)OC

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

183.053 Da

单同位素质量Monoisotopic Mass

183.053 Da

拓扑极表面积Topological Polar Surface Area

68.700 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

185.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

0.700

Reaxy-Rn

397580

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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