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13306-60-0 | Ethanone, 2,2,2-trichloro-1-(4-morpholinyl)-
CAS No: 13306-60-0 Catalog No: AG001467 MDL No:MFCD00030802
Product Description
Catalog Number:
AG001467
Chemical Name:
Ethanone, 2,2,2-trichloro-1-(4-morpholinyl)-
CAS Number:
13306-60-0
Molecular Formula:
C6H8Cl3NO2
Molecular Weight:
232.4922
MDL Number:
MFCD00030802
IUPAC Name:
2,2,2-trichloro-1-morpholin-4-ylethanone
InChI:
InChI=1S/C6H8Cl3NO2/c7-6(8,9)5(11)10-1-3-12-4-2-10/h1-4H2
InChI Key:
GDPGGCADYVWIBK-UHFFFAOYSA-N
SMILES:
O=C(C(Cl)(Cl)Cl)N1CCOCC1
NSC Number:
21056
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.962g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.485g/mol
Monoisotopic Mass:
230.962g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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