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202331-94-0 | 3-ACETYL-6-METHYL-4-PHENYL-1H-QUINOLIN-2-ONE
CAS No: 202331-94-0 Catalog No: AG01C6EW MDL No:MFCD00193216
Product Description
Catalog Number:
AG01C6EW
Chemical Name:
3-ACETYL-6-METHYL-4-PHENYL-1H-QUINOLIN-2-ONE
CAS Number:
202331-94-0
Molecular Formula:
C18H15NO2
Molecular Weight:
277.3172
MDL Number:
MFCD00193216
IUPAC Name:
3-acetyl-6-methyl-4-phenyl-1H-quinolin-2-one
InChI:
InChI=1S/C18H15NO2/c1-11-8-9-15-14(10-11)17(13-6-4-3-5-7-13)16(12(2)20)18(21)19-15/h3-10H,1-2H3,(H,19,21)
InChI Key:
DCDUKTUZOFIPJE-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c(c1ccccc1)c(c(=O)[nH]2)C(=O)C
Properties
Complexity:
474
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.11g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.323g/mol
Monoisotopic Mass:
277.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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