3H-Indeno(2,1-c)pyridazin-3-one, 2,4,4a,9-tetrahydro-
Basic information
- CAS
100595-18-4- Standard SMILES
O=C1CC2C(=NN1)Cc1ccccc12- InChIKey
NSLWKAHYUAHLNR-UHFFFAOYSA-N- Molecular formula
- C11H10N2O
- Average molar mass
- 186.21 g/mol
- Monoisotopic mass
- 186.07931295
Names & identifiers
- Preferred name
- 3H-Indeno(2,1-c)pyridazin-3-one, 2,4,4a,9-tetrahydro-
- IUPAC
- 2,4,4a,9-tetrahydroindeno[2,1-c]pyridazin-3-one
Names & synonyms
2,4,4a,9-Tetrahydro-3H-indeno(2,1-c)pyridazin-3-one100595-18-43H-Indeno(2,1-c)pyridazin-3-one, 2,4,4a,9-tetrahydro-RefChem:283163DTXSID109056134a,9-Dihydro-4H-indeno[2,1-c]pyridazin-3-ol
Database identifiers
- CAS
100595-18-4- PubChem CID
- 3063371
- DTXSID
DTXSID10905613
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 298
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Compound notes
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