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名称

噻吩-2-羧酸

分子类型

小分子

别名

2-噻吩甲酸

英文别名

英文名称

2-Thiophenecarboxylic acid

货号

T107125-10g

包装规格

10g

浓度

≥99%

运输条件

常规运输

产品介绍

水中溶解度: 80 g/L (20℃)。溶于乙醇、醚。适度溶于氯仿，微溶于石油醚。

CAS号

527-72-0

分子式

C5H4O2S

分子量

128.15 g/mol

Beilstein号

110150

EC号

208-423-4

MDL号

MFCD00005437

PubChem编号

10700

Isomeric SMILES

C1=CSC(=C1)C(=O)O

IIUPAC Name

thiophene-2-carboxylic acid

INCHI

1S/C5H4O2S/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)

InChi Key

QERYCTSHXKAMIS-UHFFFAOYSA-N

Smiles

C1=CSC(=C1)C(=O)O

PubChem CID

10700

PubChem SID

488181164

溶解性

极易溶于乙醚、酒精；可溶于氯仿

熔点

125-127°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

127.993 Da

单同位素质量Monoisotopic Mass

127.993 Da

拓扑极表面积Topological Polar Surface Area

65.500 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

103

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

1.6

密度

1.4242

沸点

260°C

Reaxy-Rn

110150

Merck Index

9354

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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