2-Propanol, 1-(butyl(2-morpholinoethyl)amino)-3-(2,4-dichlorophenoxy)-, dihydrochloride
Basic information
- CAS
21282-39-3- Standard SMILES
CCCCN(CCN1CCOCC1)CC(O)COc1ccc(Cl)cc1Cl.Cl.Cl- InChIKey
ZHBFIWAPTNMMJU-UHFFFAOYSA-N- Molecular formula
- C19H32Cl4N2O3
- Average molar mass
- 478.3 g/mol
- Monoisotopic mass
- 476.116704
Names & identifiers
- Preferred name
- 2-Propanol, 1-(butyl(2-morpholinoethyl)amino)-3-(2,4-dichlorophenoxy)-, dihydrochloride
- IUPAC
- 1-[butyl(2-morpholin-4-ylethyl)amino]-3-(2,4-dichlorophenoxy)propan-2-ol;dihydrochloride
Names & synonyms
21282-39-31-(Butyl(2-morpholinoethyl)amino)-3-(2,4-dichlorophenoxy)-2-propanol dihydrochloride2-Propanol, 1-(butyl(2-morpholinoethyl)amino)-3-(2,4-dichlorophenoxy)-, dihydrochlorideRefChem:265808DTXSID209437881-{Butyl[2-(morpholin-4-yl)ethyl]amino}-3-(2,4-dichlorophenoxy)propan-2-ol--hydrogen chloride (1/2)
Database identifiers
- CAS
21282-39-3- PubChem CID
- 210557
- DTXSID
DTXSID20943788
Properties
Computed structural properties
- Topological polar surface area
- 45.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 373
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Compound notes
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