Basic information
- CAS
20738-25-4- Standard SMILES
Sc1c(Br)ccc2cccnc12- InChIKey
ZIPUIRKPZYIHLV-UHFFFAOYSA-N- Molecular formula
- C9H6BrNS
- Average molar mass
- 240.12 g/mol
- Monoisotopic mass
- 238.94043
Names & identifiers
- Preferred name
- 7-Bromoquinoline-8-thiol
- IUPAC
- 7-bromoquinoline-8-thiol
- English name
- 7-bromoquinoline-8-thiol
- Molecular formula
- C9H6BrNS
- Molecular weight
- 240.11964
Names & synonyms
7-Bromoquinoline-8-thiol20738-25-4EINECS 244-002-17-Bromo-8-quinolinethiol8-Quinolinethiol, 7-bromo-DTXSID40174810ZIPUIRKPZYIHLV-UHFFFAOYSA-N5968YP3D2XNS00026726
Database identifiers
- CAS
20738-25-4- PubChem CID
- 88677
- DTXSID
DTXSID40174810- UNII
- 5968YP3D2X
- EC Number
- 244-002-1
- Nikkaji
- J225.322D
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 13.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 165
Chemistry & industry
Suppliers2 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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