4-(3-(1,3-Dioxolan-2-yl)-4-nitrophenyl)morpholine

HCID 86699684

Notes Reactions

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Basic information

Standard SMILES: O=[N+]([O-])c1ccc(N2CCOCC2)cc1C1OCCO1
InChIKey: IXODGEDQZMVYDA-UHFFFAOYSA-N
Molecular formula: C13H16N2O5
Average molar mass: 280.28 g/mol

Names & identifiers

Preferred name: 4-(3-(1,3-Dioxolan-2-yl)-4-nitrophenyl)morpholine
IUPAC: 4-[3-(1,3-dioxolan-2-yl)-4-nitrophenyl]morpholine

Names & synonyms

4-(3-(1,3-dioxolan-2-yl)-4-nitrophenyl)morpholine4-[3-(1,3-dioxolan-2-yl)-4-nitrophenyl]morpholineSCHEMBL15333553IXODGEDQZMVYDA-UHFFFAOYSA-NDB-3803591002556-18-4

Database identifiers

PubChem CID: 86699684

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 76.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 2
Heavy atoms: 20
Formal charge: 0
Complexity: 336

Related reactions

2 records

New reaction record

HRID 1487192As productuspto-grants-2016_08

HRID 1487193As reactantuspto-grants-2016_08

Compound notes

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