7-Isoquinolinesulfonyl chloride, 3-chloro-
Basic information
- CAS
478647-02-8- Standard SMILES
O=S(=O)(Cl)c1ccc2cc(Cl)ncc2c1- InChIKey
IOBCIDHYESEXKK-UHFFFAOYSA-N- Molecular formula
- C9H5Cl2NO2S
- Average molar mass
- 262.11 g/mol
- Monoisotopic mass
- 260.941805
Names & identifiers
- Preferred name
- 7-Isoquinolinesulfonyl chloride, 3-chloro-
- IUPAC
- 3-chloroisoquinoline-7-sulfonyl chloride
Names & synonyms
7-Isoquinolinesulfonyl chloride, 3-chloro-478647-02-83-chloroisoquinoline-7-sulfonyl chlorideSCHEMBL5142837DTXSID801275763AT540553-Chloro-7-isoquinolinesulfonyl chloride
Database identifiers
- CAS
478647-02-8- PubChem CID
- 22017184
- DTXSID
DTXSID801275763
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 327
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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