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Home > Nitro Compounds > 190728-24-6
190728-24-6 | Quinoline, 6,7-dimethoxy-4-(4-nitrophenoxy)-
CAS No: 190728-24-6 Catalog No: AG002ERL MDL No:
Product Description
Catalog Number:
AG002ERL
Chemical Name:
Quinoline, 6,7-dimethoxy-4-(4-nitrophenoxy)-
CAS Number:
190728-24-6
Molecular Formula:
C17H14N2O5
Molecular Weight:
326.3035
IUPAC Name:
6,7-dimethoxy-4-(4-nitrophenoxy)quinoline
InChI:
InChI=1S/C17H14N2O5/c1-22-16-9-13-14(10-17(16)23-2)18-8-7-15(13)24-12-5-3-11(4-6-12)19(20)21/h3-10H,1-2H3
InChI Key:
YRYKZXCOGVCXBN-UHFFFAOYSA-N
SMILES:
COc1cc2c(ccnc2cc1OC)Oc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.09g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.308g/mol
Monoisotopic Mass:
326.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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