7-Iodo-3,4-dihydroisoquinoline
Basic information
- CAS
62541-61-1- Standard SMILES
Ic1ccc2c(c1)C=NCC2- InChIKey
RPXLZKALUZPINB-UHFFFAOYSA-N- Molecular formula
- C9H8IN
- Average molar mass
- 257.07 g/mol
- Monoisotopic mass
- 256.97015
Names & identifiers
- Preferred name
- 7-Iodo-3,4-dihydroisoquinoline
- IUPAC
- 7-iodo-3,4-dihydroisoquinoline
Names & synonyms
7-iodo-3,4-dihydroisoquinoline62541-61-1Isoquinoline, 3,4-dihydro-7-iodo-DTXSID40332251DA-24703
Database identifiers
- CAS
62541-61-1- PubChem CID
- 447304
- DTXSID
DTXSID40332251
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 12.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 167
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Related reactions
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Compound notes
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