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885687-65-0 | 2-Methoxy-8-methylquinoline
CAS No: 885687-65-0 Catalog No: AG004DMN MDL No:MFCD16660313
Product Description
Catalog Number:
AG004DMN
Chemical Name:
2-Methoxy-8-methylquinoline
CAS Number:
885687-65-0
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
MDL Number:
MFCD16660313
IUPAC Name:
2-methoxy-8-methylquinoline
InChI:
InChI=1S/C11H11NO/c1-8-4-3-5-9-6-7-10(13-2)12-11(8)9/h3-7H,1-2H3
InChI Key:
YBPVXEYERZMYNR-UHFFFAOYSA-N
SMILES:
COc1ccc2c(n1)c(C)ccc2
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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