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66155-20-2 | 2-(quinolin-2-yl)-4h-chromen-4-one
CAS No: 66155-20-2 Catalog No: AG00H7VC MDL No:
Product Description
Catalog Number:
AG00H7VC
Chemical Name:
2-(quinolin-2-yl)-4h-chromen-4-one
CAS Number:
66155-20-2
Molecular Formula:
C18H11NO2
Molecular Weight:
273.2854
IUPAC Name:
2-quinolin-2-ylchromen-4-one
InChI:
InChI=1S/C18H11NO2/c20-16-11-18(21-17-8-4-2-6-13(16)17)15-10-9-12-5-1-3-7-14(12)19-15/h1-11H
InChI Key:
MDNRNVVTFCHINB-UHFFFAOYSA-N
SMILES:
O=c1cc(oc2c1cccc2)c1ccc2c(n1)cccc2
NSC Number:
49655
Properties
Complexity:
445
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.079g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.291g/mol
Monoisotopic Mass:
273.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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