Basic information
- CAS
2238-78-0- Standard SMILES
C=CCC(O)(CCN1CCOCC1)c1ccc(Cl)cc1.Cl- InChIKey
YHTXFMNXYBIITD-UHFFFAOYSA-N- Molecular formula
- C16H23Cl2NO2
- Average molar mass
- 332.3 g/mol
- Monoisotopic mass
- 331.1105844
Names & identifiers
- Preferred name
- 3-(4-Chlorophenyl)-1-(morpholin-4-yl)hex-5-en-3-ol--hydrogen chloride (1/1)
- IUPAC
- 3-(4-chlorophenyl)-1-morpholin-4-ylhex-5-en-3-ol;hydrochloride
Names & synonyms
2238-78-0DTXSID309450313-(4-Chlorophenyl)-1-(morpholin-4-yl)hex-5-en-3-ol--hydrogen chloride (1/1)RefChem:1066810DTXCID101373358alpha-Allyl-alpha-(p-chlorophenyl)-4-morpholinepropanol hydrochloride4-Morpholinepropanol, alpha-allyl-alpha-(p-chlorophenyl)-, hydrochloride
Database identifiers
- CAS
2238-78-0- PubChem CID
- 200538
- DTXSID
DTXSID30945031
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 299
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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