3-(3,5-Dichloro-2-aminophenyl)-5,6-dihydro-1,4,2-dioxazine

HCID 57731173
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Basic information

Standard SMILES
Nc1c(Cl)cc(Cl)cc1C1=NOCCO1
InChIKey
OHRJEEMTOALRKW-UHFFFAOYSA-N
Molecular formula
C9H8Cl2N2O2
Average molar mass
247.07 g/mol

Names & identifiers

Preferred name
3-(3,5-Dichloro-2-aminophenyl)-5,6-dihydro-1,4,2-dioxazine
IUPAC
2,4-dichloro-6-(5,6-dihydro-1,4,2-dioxazin-3-yl)aniline

Names & synonyms

SCHEMBL112042OHRJEEMTOALRKW-UHFFFAOYSA-N3-(3,5-dichloro-2-aminophenyl)-5,6-dihydro-1,4,2-dioxazine

Database identifiers

PubChem CID
57731173

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
56.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
15

Related reactions

3 records
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Compound notes

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