Morpholine, 1-(4-(p-phenoxymethylphenyl)butyl)-
Basic information
- CAS
19733-87-0- Standard SMILES
c1ccc(OCc2ccc(CCCCN3CCOCC3)cc2)cc1- InChIKey
PCSCOVYTYNORPK-UHFFFAOYSA-N- Molecular formula
- C21H27NO2
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 325.2041791
Names & identifiers
- Preferred name
- Morpholine, 1-(4-(p-phenoxymethylphenyl)butyl)-
- IUPAC
- 4-[4-[4-(phenoxymethyl)phenyl]butyl]morpholine
- English name
- 4-[4-[4-(phenoxymethyl)phenyl]butyl]morpholine
- Molecular formula
- C21H27NO2
- Molecular weight
- 325.44
Names & synonyms
19733-87-0BRN 0300281Morpholine, 1-(4-(p-phenoxymethylphenyl)butyl)-1-(4-(p-Phenoxymethylphenyl)butyl)morpholineDTXSID601734214-27-00-00169 (Beilstein Handbook Reference)RefChem:357483DTXCID00959124-[4-[4-(phenoxymethyl)phenyl]butyl]morpholine4-{4-[4-(phenoxymethyl)phenyl]butyl}morpholineAKOS0160355264-[4-[p-(Phenoxymethyl)phenyl]butyl]morpholine
Show more names
Morpholine, 4-[4-[4-(phenoxymethyl)phenyl]butyl]-
Database identifiers
- CAS
19733-87-0- PubChem CID
- 209338
- DTXSID
DTXSID60173421- Nikkaji
- J41.799H
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 316
Physicochemical properties
- Boiling point
- 472.3 · 472.3±40.0 °C(Predicted)
- Density
- 1.068 · 1.068±0.06 g/cm3(Predicted)
- pka
- 7.55 · 7.55±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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