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15113-00-5 | Quinoline, 2-methoxy-4-methyl-
CAS No: 15113-00-5 Catalog No: AG001N3Z MDL No:MFCD02292848
Product Description
Catalog Number:
AG001N3Z
Chemical Name:
Quinoline, 2-methoxy-4-methyl-
CAS Number:
15113-00-5
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
MDL Number:
MFCD02292848
IUPAC Name:
2-methoxy-4-methylquinoline
InChI:
InChI=1S/C11H11NO/c1-8-7-11(13-2)12-10-6-4-3-5-9(8)10/h3-7H,1-2H3
InChI Key:
QILUVAHCFWCERZ-UHFFFAOYSA-N
SMILES:
COc1cc(C)c2c(n1)cccc2
EC Number:
239-166-6
UNII:
M7R2LY5WHN
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.215g/mol
Monoisotopic Mass:
173.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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