2-(Morpholin-4-yl)ethyl 2-butoxy-3-methoxybenzoate--hydrogen chloride (1/1)
Basic information
- CAS
23966-68-9- Standard SMILES
CCCCOc1c(OC)cccc1C(=O)OCC[NH+]1CCOCC1.[Cl-]- InChIKey
IWCUVTAPPKKOFE-UHFFFAOYSA-N- Molecular formula
- C18H28ClNO5
- Average molar mass
- 373.9 g/mol
- Monoisotopic mass
- 373.1656007
Names & identifiers
- Preferred name
- 2-(Morpholin-4-yl)ethyl 2-butoxy-3-methoxybenzoate--hydrogen chloride (1/1)
- IUPAC
- 2-morpholin-4-ium-4-ylethyl 2-butoxy-3-methoxybenzoate chloride
Names & synonyms
23966-68-9DTXSID809468162-(Morpholin-4-yl)ethyl 2-butoxy-3-methoxybenzoate--hydrogen chloride (1/1)RefChem:1061924DTXCID2013750902-Butoxy-3-methoxybenzoic acid 2-morpholinoethyl ester hydrochlorideBENZOIC ACID, 2-BUTOXY-3-METHOXY-, 2-MORPHOLINOETHYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
23966-68-9- PubChem CID
- 32171
Properties
Computed structural properties
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 359
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Compound notes
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