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53207-52-6 | 2,3-Dihydro-1,3,3-trimethylquinolin-4(1H)-one
CAS No: 53207-52-6 Catalog No: AG00DUB7 MDL No:
Product Description
Catalog Number:
AG00DUB7
Chemical Name:
2,3-Dihydro-1,3,3-trimethylquinolin-4(1H)-one
CAS Number:
53207-52-6
IUPAC Name:
1,3,3-trimethyl-2H-quinolin-4-one
InChI:
InChI=1S/C12H15NO/c1-12(2)8-13(3)10-7-5-4-6-9(10)11(12)14/h4-7H,8H2,1-3H3
InChI Key:
CDRRBVFIMBIPIT-UHFFFAOYSA-N
NSC Number:
201324
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:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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