ETHANOL, 2-(ETHYL(3-(p-(PHENOXYMETHYL)PHENYL)PROPYL)AMINO)-

HCID 58207

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Basic information

CAS: 101221-52-7
Standard SMILES: CCN(CCO)CCCc1ccc(COc2ccccc2)cc1
InChIKey: MEROUACRXRYNCF-UHFFFAOYSA-N
Molecular formula: C20H27NO2
Average molar mass: 313.4 g/mol
Monoisotopic mass: 313.2041791

Names & identifiers

Preferred name: ETHANOL, 2-(ETHYL(3-(p-(PHENOXYMETHYL)PHENYL)PROPYL)AMINO)-
IUPAC: 2-[ethyl-[3-[4-(phenoxymethyl)phenyl]propyl]amino]ethanol

Names & synonyms

ETHANOL, 2-(ETHYL(3-(p-(PHENOXYMETHYL)PHENYL)PROPYL)AMINO)-101221-52-7BRN 34070302-(Ethyl(3-(p-(phenoxymethyl)phenyl)propyl)amino)ethanolAethyl-(2-hydroxy-aethyl)-(3-(4-phenoxymethyl-phenyl)propyl)amin [German]DTXSID50143794Aethyl-(2-hydroxy-aethyl)-(3-(4-phenoxymethyl-phenyl)propyl)amin2-(Ethyl{3-[4-(phenoxymethyl)phenyl]propyl}amino)ethan-1-ol

Database identifiers

CAS: 101221-52-7
PubChem CID: 58207
DTXSID: DTXSID50143794
Nikkaji: J92.965D

Properties

Computed structural properties

XLogP: 3.9
Topological polar surface area: 32.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 10
Heavy atoms: 23
Formal charge: 0
Complexity: 283

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