5-chloro-4H-pyrido[4,3-b][1,4]oxazin-3-one


Chemical Name: 5-chloro-4H-pyrido[4,3-b][1,4]oxazin-3-one
CAS Number: 1378678-80-8
Product Number: AG0013ZE(AGN-PC-0JK1IE)
Synonyms:
MDL No:
Molecular Formula: C7H5ClN2O2
Molecular Weight: 184.5798

Identification/Properties


Computed Properties
Molecular Weight:
184.579g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
184.004g/mol
Monoisotopic Mass:
184.004g/mol
Topological Polar Surface Area:
51.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
200
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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