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Product details

名称

2,2-二甲基琥珀酸

分子类型

小分子

别名

2,2-二甲基丁二酸 | 2,2-二甲基-1,4-丁烷二酸

英文别名

英文名称

2,2-Dimethylsuccinic Acid

货号

D107306-500g

包装规格

500g

浓度

≥98%

运输条件

常规运输

CAS号

597-43-3

分子式

C6H10O4

分子量

146.14 g/mol

Beilstein号

1764476

EC号

209-899-6

MDL号

MFCD00004196

PubChem编号

11701

Isomeric SMILES

CC(C)(CC(=O)O)C(=O)O

IIUPAC Name

2,2-dimethylbutanedioic acid

INCHI

1S/C6H10O4/c1-6(2,5(9)10)3-4(7)8/h3H2,1-2H3,(H,7,8)(H,9,10)

InChi Key

GOHPTLYPQCTZSE-UHFFFAOYSA-N

Smiles

CC(C)(CC(=O)O)C(=O)O

PubChem SID

488181409

熔点

138-142°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

146.058 Da

单同位素质量Monoisotopic Mass

146.058 Da

拓扑极表面积Topological Polar Surface Area

74.600 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

159.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

0.200

密度

1.3879

Reaxy-Rn

1764476

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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