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879-56-1 | 7-Methoxy-2,3-dihydroquinolin-4(1H)-one
CAS No: 879-56-1 Catalog No: AG008BWA MDL No:MFCD00796999
Product Description
Catalog Number:
AG008BWA
Chemical Name:
7-Methoxy-2,3-dihydroquinolin-4(1H)-one
CAS Number:
879-56-1
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD00796999
IUPAC Name:
7-methoxy-2,3-dihydro-1H-quinolin-4-one
InChI:
InChI=1S/C10H11NO2/c1-13-7-2-3-8-9(6-7)11-5-4-10(8)12/h2-3,6,11H,4-5H2,1H3
InChI Key:
FXMJBPUDUVWRGI-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)NCCC2=O
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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