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121909-61-3 | 5H,12H-Quino[2,1-b][1,3]benzoxazin-5-one, 6-chloro-
CAS No: 121909-61-3 Catalog No: AG0016DR MDL No:
Product Description
Catalog Number:
AG0016DR
Chemical Name:
5H,12H-Quino[2,1-b][1,3]benzoxazin-5-one, 6-chloro-
CAS Number:
121909-61-3
Molecular Formula:
C16H10ClNO2
Molecular Weight:
283.7091
IUPAC Name:
6-chloro-12H-quinolino[2,1-b][1,3]benzoxazin-5-one
InChI:
InChI=1S/C16H10ClNO2/c17-14-15(19)11-6-2-3-7-12(11)18-9-10-5-1-4-8-13(10)20-16(14)18/h1-8H,9H2
InChI Key:
MAWBAAFCYQYINO-UHFFFAOYSA-N
SMILES:
O=c1c(Cl)c2Oc3ccccc3Cn2c2c1cccc2
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.04g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.711g/mol
Monoisotopic Mass:
283.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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