Dataset
process
Chemical Info
InChI | InChI=1S/C5H4BrNO/c6-5-1-3-7(8)4-2-5/h1-4H |
---|---|
SMILES | [O-][n+]1ccc(cc1)Br |
InChI Key | ZRXLKDCFWJECNO-UHFFFAOYSA-N |
Molecular Formula | C5H4BrNO |
Exact Mass | 173.995 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/ZRXLKDCFWJECNO-UHFFFAOYSA-N/Others |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/ZRXLKDCFWJECNO-UHFFFAOYSA-N/Others |
Version | |
Author | Hannes Kühner |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T00:51:56.825471 |
MetadataModified | 2024-09-07T14:46:09.678647 |
MetadataPublished | 2019-02-13 |
Field | Value |
---|---|
Measurement Technique | process |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
16496151 | PubChem: Thomson Pharma |
139708 | PubChem |
14248-50-1 | ACToR |
SCHEMBL307778 | SureChEMBL |
J702.063E | Nikkaji |
ZINC000000051190 | ZINC |
CB21175837 | ChemicalBook |
DTXSID60162057 | EPA CompTox Dashboard |
31485719 | eMolecules |
The data in this table is sourced from UniChem at EBI. |