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78558-34-6 | 1-Oxa-4-azaspiro[4.5]decane, 4-(dichloroacetyl)-3-ethyl-
CAS No: 78558-34-6 Catalog No: AG005KUD MDL No:
Product Description
Catalog Number:
AG005KUD
Chemical Name:
1-Oxa-4-azaspiro[4.5]decane, 4-(dichloroacetyl)-3-ethyl-
CAS Number:
78558-34-6
Molecular Formula:
C12H19Cl2NO2
Molecular Weight:
280.1908
IUPAC Name:
2,2-dichloro-1-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-4-yl)ethanone
InChI:
InChI=1S/C12H19Cl2NO2/c1-2-9-8-17-12(6-4-3-5-7-12)15(9)11(16)10(13)14/h9-10H,2-8H2,1H3
InChI Key:
GTEZDOUWLRZBLY-UHFFFAOYSA-N
SMILES:
CCC1COC2(N1C(=O)C(Cl)Cl)CCCCC2
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.079g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.189g/mol
Monoisotopic Mass:
279.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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