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16344-42-6 | Benzo[b][1,8]naphthyridin-5(10H)-one, 7-chloro-
CAS No: 16344-42-6 Catalog No: AG001U4L MDL No:
Product Description
Catalog Number:
AG001U4L
Chemical Name:
Benzo[b][1,8]naphthyridin-5(10H)-one, 7-chloro-
CAS Number:
16344-42-6
Molecular Formula:
C12H7ClN2O
Molecular Weight:
230.6498
IUPAC Name:
7-chloro-10H-benzo[b][1,8]naphthyridin-5-one
InChI:
InChI=1S/C12H7ClN2O/c13-7-3-4-10-9(6-7)11(16)8-2-1-5-14-12(8)15-10/h1-6H,(H,14,15,16)
InChI Key:
VIBDVDUNJWRQNJ-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)c(=O)c1c([nH]2)nccc1
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.025g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.651g/mol
Monoisotopic Mass:
230.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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