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Home > Nitro Compounds > 83054-25-5
83054-25-5 | Naphthalene, 1-methoxy-4-(2-methoxy-4-nitrophenoxy)-
CAS No: 83054-25-5 Catalog No: AG0052L1 MDL No:
Product Description
Catalog Number:
AG0052L1
Chemical Name:
Naphthalene, 1-methoxy-4-(2-methoxy-4-nitrophenoxy)-
CAS Number:
83054-25-5
Molecular Formula:
C18H15NO5
Molecular Weight:
325.3154
IUPAC Name:
1-methoxy-4-(2-methoxy-4-nitrophenoxy)naphthalene
InChI:
InChI=1S/C18H15NO5/c1-22-15-9-10-16(14-6-4-3-5-13(14)15)24-17-8-7-12(19(20)21)11-18(17)23-2/h3-11H,1-2H3
InChI Key:
VSQARESDJRIKSA-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1Oc1ccc(c2c1cccc2)OC)[N+](=O)[O-]
Properties
Complexity:
426
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.095g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.32g/mol
Monoisotopic Mass:
325.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
73.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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