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52481-90-0 | 4(1H)-Quinolinone, 2,5-dimethyl-
CAS No: 52481-90-0 Catalog No: AG006TUG MDL No:MFCD24560629
Product Description
Catalog Number:
AG006TUG
Chemical Name:
4(1H)-Quinolinone, 2,5-dimethyl-
CAS Number:
52481-90-0
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
MDL Number:
MFCD24560629
IUPAC Name:
2,5-dimethyl-1H-quinolin-4-one
InChI:
InChI=1S/C11H11NO/c1-7-4-3-5-9-11(7)10(13)6-8(2)12-9/h3-6H,1-2H3,(H,12,13)
InChI Key:
DSOBBWSUYIYTLE-UHFFFAOYSA-N
SMILES:
Cc1[nH]c2cccc(c2c(=O)c1)C
NSC Number:
31462
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.215g/mol
Monoisotopic Mass:
173.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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