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名称

有机砌块

英文别名

4,10-dibromo-3,7,11-trithiatricyclo[6.3.0.0^{2,6]undeca-1(8),2(6),4,9-tetraene | SB66789 | DTXSID40464223 | DS-4126 | 2,6-Dibromodithieno[3,2-b:2',3'-d]thiophene, >97% | UTKPZZGBROTDKR-UHFFFAOYSA-N | 4,10-dibromo-3,7,11-trithiatricyclo[6.3.0.02,6]undeca-1

英文名称

2，6-Dibromodithieno[3，2-b:2’，3’-d]thiophene

货号

D133978-1g

包装规格

浓度

≥97%

储存温度

2-8°C储存,充氩

运输条件

冰袋运输

敏感性

对热、光线、空气敏感

CAS号

67061-69-2

分子式

C8H2Br2S3

分子量

354.09 g/mol

PubChem编号

11382649

Isomeric SMILES

C1=C(SC2=C1SC3=C2SC(=C3)Br)Br

IIUPAC Name

4,10-dibromo-3,7,11-trithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene

INCHI

1S/C8H2Br2S3/c9-5-1-3-7(12-5)8-4(11-3)2-6(10)13-8/h1-2H

InChi Key

UTKPZZGBROTDKR-UHFFFAOYSA-N

Smiles

C1=C(SC2=C1SC3=C2SC(=C3)Br)Br

溶解性

可溶于甲苯

熔点

171 °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

353.766 Da

单同位素质量Monoisotopic Mass

351.769 Da

拓扑极表面积Topological Polar Surface Area

84.700 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

203.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

5.900

Reaxy-Rn

4805474

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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