7,8-dibromophenazine-2,3-dicarbonitrile

This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
InChI descriptor[cheminf_000113]: InChI=1S/C14H4Br2N4/c15-9-3-13-14(4-10(9)16)20-12-2-8(6-18)7(5-17)1-11(12)19-13/h1-4H, and canonical SMILES descriptor[cheminf_000007]: N#Cc1cc2nc3cc(Br)c(cc3nc2cc1C#N)Br, and by the IUPAC name[cheminf_000107]: .

The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:

The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-46045

The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
Melting point descriptor[CHEMINF_000256]:
Boiling point descriptor[CHEMINF_000257]:
Refractive index descriptor[CHEMINF_000253]:

The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:

CHMO:0000763 | attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)

CHMO:0000470 | mass spectrometry (MS)

The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID:

Used ontologies:
CHEBI - Chemical Entities of Biological Interest
CHEMINF - chemical information ontology (information entities about chemical entities)
CHMO - Chemical Methods Ontology
OBI - Ontology for Biomedical Investigations

本条目描述的是与分子[CHEBI_25367]相关联的物理化学实体[CHEBI_24431]。
该分子[CHEBI_25367]可通过以下结构描述符[cheminf_000085]进行表征：
InChI描述符[cheminf_000113]：InChI=1S/C14H4Br2N4/c15-9-3-13-14(4-10(9)16)20-12-2-8(6-18)7(5-17)1-11(12)19-13/h1-4H；
标准SMILES描述符[cheminf_000007]：N#Cc1cc2nc3cc(Br)c(cc3nc2cc1C#N)Br；
IUPAC命名[cheminf_000107]：（未提供具体内容）。

该物理化学实体[CHEBI_24431]含有组分溶剂[CHEBI_46787]，其可通过标准SMILES描述符[cheminf_000007]表征：（原文未提供具体内容）。

该物理化学实体[CHEBI_24431]在科研数据仓储chemotion（www.chemotion-repository.net，https://doi.org/10.25504/FAIRsharing.iagXcR）中注册的样本编号为：CRS-46045。

该物理化学实体[CHEBI_24431]可通过以下物理描述符[CHEMINF_000025]表征：
熔点描述符[CHEMINF_000256]：（未提供数据）；
沸点描述符[CHEMINF_000257]：（未提供数据）；
折射率描述符[CHEMINF_000253]：（未提供数据）。

该物理化学实体[CHEBI_24431]还可通过以下检测实验[OBI:0000070][CHMO:0001133]进行表征：
CHMO:0000763 | 衰减全反射傅里叶变换红外光谱（ATR-FTIR）
CHMO:0000470 | 质谱分析法（MS）

该物理化学实体[CHEBI_24431]已被存入卡尔斯鲁厄理工学院（KIT）的分子档案库，对应样本编号为：（原文未提供具体内容）。

所用本体：
CHEBI - 生物兴趣化学实体（Chemical Entities of Biological Interest）
CHEMINF - 化学信息本体（针对化学实体的信息实体）
CHMO - 化学方法本体（Chemical Methods Ontology）
OBI - 生物调查本体（Ontology for Biomedical Investigations）