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181122-00-9 | 2(1H)-Quinolinone, 3,4-dihydro-4,4,6-trimethyl-
CAS No: 181122-00-9 Catalog No: AG0022P3 MDL No:MFCD12913845
Product Description
Catalog Number:
AG0022P3
Chemical Name:
2(1H)-Quinolinone, 3,4-dihydro-4,4,6-trimethyl-
CAS Number:
181122-00-9
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD12913845
IUPAC Name:
4,4,6-trimethyl-1,3-dihydroquinolin-2-one
InChI:
InChI=1S/C12H15NO/c1-8-4-5-10-9(6-8)12(2,3)7-11(14)13-10/h4-6H,7H2,1-3H3,(H,13,14)
InChI Key:
XQSXUDFDIMWBNI-UHFFFAOYSA-N
SMILES:
O=C1Nc2ccc(cc2C(C1)(C)C)C
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/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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