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3033-80-5 | Quinoline, 8-methoxy-2-methyl-
CAS No: 3033-80-5 Catalog No: AG002ZRX MDL No:MFCD00034436
Product Description
Catalog Number:
AG002ZRX
Chemical Name:
Quinoline, 8-methoxy-2-methyl-
CAS Number:
3033-80-5
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
MDL Number:
MFCD00034436
IUPAC Name:
8-methoxy-2-methylquinoline
InChI:
InChI=1S/C11H11NO/c1-8-6-7-9-4-3-5-10(13-2)11(9)12-8/h3-7H,1-2H3
InChI Key:
OQXVXPBDSJQYRR-UHFFFAOYSA-N
SMILES:
COc1cccc2c1nc(C)cc2
NSC Number:
246071
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:
2.7
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