Basic information
- CAS
66827-54-1- Standard SMILES
CN1C(=N)OC2c3cccc4cccc(c34)C21.Cl- InChIKey
KSSUSYJDBNEPQC-UHFFFAOYSA-N- Molecular formula
- C14H13ClN2O
- Average molar mass
- 260.72 g/mol
- Monoisotopic mass
- 260.0716407
Names & identifiers
- Preferred name
- Acenaphth(1,2-d)oxazole, 6b,9a-dihydro-8-imino-9-methyl-, hydrochloride
- IUPAC
- 9-methyl-6b,9a-dihydroacenaphthyleno[1,2-d][1,3]oxazol-8-imine;hydrochloride
Names & synonyms
6b,9a-Dihydro-8-imino-9-methylacenaphth(1,2-d)oxazole hydrochloride66827-54-1Acenaphth(1,2-d)oxazole, 6b,9a-dihydro-8-imino-9-methyl-, hydrochlorideRefChem:314211DTXSID009854099-Methyl-9,9a-dihydroacenaphtho[1,2-d][1,3]oxazol-8(6bH)-imine--hydrogen chloride (1/1)
Database identifiers
- CAS
66827-54-1- PubChem CID
- 3050596
- DTXSID
DTXSID00985409
Properties
Computed structural properties
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 356
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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