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(2,6-Dichloropyridin-3-yl)(morpholino)methanone

HCID 796223
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Basic information

CAS
415700-14-0
Standard SMILES
O=C(c1ccc(Cl)nc1Cl)N1CCOCC1
InChIKey
PLAVALNMGZAHSU-UHFFFAOYSA-N
Molecular formula
C10H10Cl2N2O2
Average molar mass
261.1 g/mol
Monoisotopic mass
260.011933

Names & identifiers

Preferred name
(2,6-Dichloropyridin-3-yl)(morpholino)methanone
IUPAC
(2,6-dichloro-3-pyridinyl)-morpholin-4-ylmethanone
English name
(2,6-dichloropyridin-3-yl)(Morpholino)Methanone
Molecular formula
C10H10Cl2N2O2
Molecular weight
261.1

Names & synonyms

(2,6-dichloropyridin-3-yl)(morpholino)methanone415700-14-0(2,6-dichloropyridin-3-yl)-morpholin-4-ylmethanone4-(2,6-DICHLOROPYRIDINE-3-CARBONYL)MORPHOLINEDTXSID40355304GEO-03564MFCD00452935DB-299517H79246SR-01000205695SR-01000205695-1(2,6-Dichloropyridin-3-yl)(morpholin-4-yl)methanone
Show more names
Methanone, (2,6-dichloro-3-pyridinyl)-4-morpholinyl-

Database identifiers

CAS
415700-14-0
PubChem CID
796223
DTXSID
DTXSID40355304

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
42.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
259

Physicochemical properties

Boiling point
452.3 · 452.3±45.0 °C(Predicted)
Density
1.429 · 1.429±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
-2.84 · -2.84±0.20(Predicted)

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