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121400-29-1 | 7H-Naphtho[1,8-fg]quinolin-7-one
CAS No: 121400-29-1 Catalog No: AG0076ZT MDL No:
Product Description
Catalog Number:
AG0076ZT
Chemical Name:
7H-Naphtho[1,8-fg]quinolin-7-one
CAS Number:
121400-29-1
Molecular Formula:
C16H9NO
Molecular Weight:
231.2488
IUPAC Name:
phenaleno[2,1-b]pyridin-7-one
InChI:
InChI=1S/C16H9NO/c18-16-13-7-2-5-10-4-1-6-11(14(10)13)12-8-3-9-17-15(12)16/h1-9H
InChI Key:
BWIQXPCSEXVLFD-UHFFFAOYSA-N
SMILES:
O=C1c2ncccc2c2c3c1cccc3ccc2
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.068g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.254g/mol
Monoisotopic Mass:
231.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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