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117638-94-5 | Quinoline, 5,6,7-trimethoxy-2-methyl-
CAS No: 117638-94-5 Catalog No: AG0077L2 MDL No:
Product Description
Catalog Number:
AG0077L2
Chemical Name:
Quinoline, 5,6,7-trimethoxy-2-methyl-
CAS Number:
117638-94-5
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
IUPAC Name:
5,6,7-trimethoxy-2-methylquinoline
InChI:
InChI=1S/C13H15NO3/c1-8-5-6-9-10(14-8)7-11(15-2)13(17-4)12(9)16-3/h5-7H,1-4H3
InChI Key:
INMDDQVJJJTESK-UHFFFAOYSA-N
SMILES:
COc1cc2nc(C)ccc2c(c1OC)OC
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.105g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.267g/mol
Monoisotopic Mass:
233.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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