Basic information
- CAS
53774-90-6- Standard SMILES
Cl.Cl.O=C1C(CN2CCOCC2)CCCCCC1CN1CCOCC1- InChIKey
PUKWYSIHBDOAML-UHFFFAOYSA-N- Molecular formula
- C18H34Cl2N2O3
- Average molar mass
- 397.4 g/mol
- Monoisotopic mass
- 396.1946483
Names & identifiers
- Preferred name
- 2,8-Bis(4-morpholinylmethyl)cyclooctanone dihydrochloride
- IUPAC
- 2,8-bis(morpholin-4-ylmethyl)cyclooctan-1-one;dihydrochloride
Names & synonyms
2,8-Bis(4-morpholinylmethyl)cyclooctanone dihydrochloride53774-90-62,8-Bis(N-morpholinomethyl)-cyclooctanone dihydrochlorideCyclooctanone, 2,8-bis(4-morpholinylmethyl)-, dihydrochlorideDTXSID009685502,8-Bis[(morpholin-4-yl)methyl]cyclooctan-1-one--hydrogen chloride (1/2)
Database identifiers
- CAS
53774-90-6- PubChem CID
- 3045397
- DTXSID
DTXSID00968550
Properties
Computed structural properties
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 333
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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