4-Tert-butyl-2-(3-chlorophenyl)morpholine

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Basic information

CAS: 119491-99-5
Standard SMILES: CC(C)(C)N1CCOC(c2cccc(Cl)c2)C1
InChIKey: XNEVATPUJAWEMS-UHFFFAOYSA-N
Molecular formula: C14H20ClNO
Average molar mass: 253.77 g/mol
Monoisotopic mass: 253.123342

Names & identifiers

Preferred name: 4-Tert-butyl-2-(3-chlorophenyl)morpholine
IUPAC: 4-tert-butyl-2-(3-chlorophenyl)morpholine
English name: 4-tert-Butyl-2-(3-chlorophenyl)-morpholine
Molecular formula: C14H20ClNO
Molecular weight: 253.77

Names & synonyms

119491-99-54-tert-butyl-2-(3-chlorophenyl)morpholine4-TERT-BUTYL-2-(3-CHLOROPHENYL)-MORPHOLINESCHEMBL9640630DTXSID50601268AKOS015908730DB-081498Morpholine, 2-(3-chlorophenyl)-4-(1,1-dimethylethyl)-

Database identifiers

CAS: 119491-99-5
PubChem CID: 19913613
DTXSID: DTXSID50601268

Properties

Computed structural properties

XLogP: 3.5
Topological polar surface area: 12.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 17
Formal charge: 0
Complexity: 251

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