Basic information
- CAS
47351-77-9- Standard SMILES
CCCCOc1cc(N2CCOCC2)c(OCCCC)cc1[N+]#N- InChIKey
NJLLALPCADBTIS-UHFFFAOYSA-N- Molecular formula
- C18H28N3O3+
- Average molar mass
- 334.4 g/mol
- Monoisotopic mass
- 334.21306676
Names & identifiers
- Preferred name
- Benzenediazonium, 2,5-dibutoxy-4-(4-morpholinyl)-
- IUPAC
- 2,5-dibutoxy-4-morpholin-4-ylbenzenediazonium
Names & synonyms
Benzenediazonium, 2,5-dibutoxy-4-(4-morpholinyl)-47351-77-92,5-dibutoxy-4-(morpholin-4-yl)benzene-1-diazoniumSCHEMBL1273877SCHEMBL29837430DTXSID10275762AKOS025396748
Database identifiers
- CAS
47351-77-9- PubChem CID
- 78574
- DTXSID
DTXSID10275762- Nikkaji
- J264.822I
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 1
- Complexity
- 392
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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