Acetic acid, (m-methoxyphenoxy)-, 2-morpholinoethyl ester, hydrochloride

HCID 37077

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Basic information

CAS: 35158-66-8
Standard SMILES: COc1cccc(OCC(=O)OCCC2C[NH2+]CCO2)c1.[Cl-]
InChIKey: KNXCWOWISGDPQK-UHFFFAOYSA-N
Molecular formula: C15H22ClNO5
Average molar mass: 331.79 g/mol
Monoisotopic mass: 331.1186505

Names & identifiers

Preferred name: Acetic acid, (m-methoxyphenoxy)-, 2-morpholinoethyl ester, hydrochloride
IUPAC: 2-morpholin-4-ium-2-ylethyl 2-(3-methoxyphenoxy)acetate chloride

Names & synonyms

35158-66-8ACETIC ACID, (m-METHOXYPHENOXY)-, 2-MORPHOLINOETHYL ESTER, HYDROCHLORIDERefChem:1075655(m-Methoxyphenoxy)acetic acid 2-morpholinoethyl ester hydrochlorideMorpholinoethyl m-methoxyphenoxyacetate hydrochloride

Database identifiers

CAS: 35158-66-8
PubChem CID: 37077

Properties

Computed structural properties

Topological polar surface area: 70.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 8
Heavy atoms: 22
Formal charge: 0
Complexity: 312

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