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1531-38-0 | 1-phenyl-2-(quinolin-2-yl)ethan-1-one
CAS No: 1531-38-0 Catalog No: AG00WULO MDL No:MFCD10694866
Product Description
Catalog Number:
AG00WULO
Chemical Name:
1-phenyl-2-(quinolin-2-yl)ethan-1-one
CAS Number:
1531-38-0
Molecular Formula:
C17H13NO
Molecular Weight:
247.2912
MDL Number:
MFCD10694866
IUPAC Name:
1-phenyl-2-quinolin-2-ylethanone
InChI:
InChI=1S/C17H13NO/c19-17(14-7-2-1-3-8-14)12-15-11-10-13-6-4-5-9-16(13)18-15/h1-11H,12H2
InChI Key:
MIHMEDBBAZVCAR-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Cc1ccc2c(n1)cccc2
NSC Number:
3329
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.1g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.297g/mol
Monoisotopic Mass:
247.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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