Basic information
- Standard SMILES
NNC1=NCCc2ccccc21- InChIKey
XEGRMRPYXFRYBK-UHFFFAOYSA-N- Molecular formula
- C9H11N3
- Average molar mass
- 161.2 g/mol
- Monoisotopic mass
- 161.09529735
Names & identifiers
- Preferred name
- 1-Hydrazinyl-3,4-dihydroisoquinoline
- IUPAC
- 3,4-dihydroisoquinolin-1-ylhydrazine
Names & synonyms
1-Hydrazinyl-3,4-dihydroisoquinoline26406-38-2DTXSID90493129RefChem:230807DTXCID60443939CHEMBL3276082SCHEMBL11745466XEGRMRPYXFRYBK-UHFFFAOYSA-N1-hydrazino-3,4-dihydroisoquinoline1-hydrazono-3,4-dihydroisoquinoline3,4-dihydroisoquinolin-1-ylhydrazineAKOS006336080
Database identifiers
- CAS
26406-38-2- PubChem CID
- 12349041
- DTXSID
DTXSID90493129- ChEMBL
CHEMBL3276082
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 188
Related reactions
21 records
Linked notes
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