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Product details

名称

有机砌块

英文别名

英文名称

Dimethyl 4-aminoisophthalate

货号

D589760-100mg

包装规格

100mg

储存温度

2-8°C储存,避光,充氩

运输条件

冰袋运输

CAS号

63746-12-3

分子式

C10H11NO4

分子量

209.2 g/mol

PubChem编号

11095854

Isomeric SMILES

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

IIUPAC Name

dimethyl 4-aminobenzene-1,3-dicarboxylate

INCHI

1S/C10H11NO4/c1-14-9(12)6-3-4-8(11)7(5-6)10(13)15-2/h3-5H,11H2,1-2H3

InChi Key

QWENMFNFBJHLTE-UHFFFAOYSA-N

Smiles

COC(=O)C1=CC(=C(C=C1)N)C(=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

209.069 Da

单同位素质量Monoisotopic Mass

209.069 Da

拓扑极表面积Topological Polar Surface Area

78.600 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

254.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

2.500

Reaxy-Rn

2941135

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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