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100372-30-3 | Quinoline, 4-ethoxy-6-methoxy-2-methyl-
CAS No: 100372-30-3 Catalog No: AG0001T1 MDL No:
Product Description
Catalog Number:
AG0001T1
Chemical Name:
Quinoline, 4-ethoxy-6-methoxy-2-methyl-
CAS Number:
100372-30-3
Molecular Formula:
C13H15NO2
Molecular Weight:
217.2637
IUPAC Name:
4-ethoxy-6-methoxy-2-methylquinoline
InChI:
InChI=1S/C13H15NO2/c1-4-16-13-7-9(2)14-12-6-5-10(15-3)8-11(12)13/h5-8H,4H2,1-3H3
InChI Key:
PFMVDACDHIAQOH-UHFFFAOYSA-N
SMILES:
CCOc1cc(C)nc2c1cc(OC)cc2
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.11g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.268g/mol
Monoisotopic Mass:
217.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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