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Home > Nitro Compounds > 832737-59-4
832737-59-4 | 3-(4-Ethoxy-phenoxymethyl)-1-nitro-benzene
CAS No: 832737-59-4 Catalog No: AG01EXL8 MDL No:
Product Description
Catalog Number:
AG01EXL8
Chemical Name:
3-(4-Ethoxy-phenoxymethyl)-1-nitro-benzene
CAS Number:
832737-59-4
Molecular Formula:
C15H15NO4
Molecular Weight:
273.2839
IUPAC Name:
1-[(4-ethoxyphenoxy)methyl]-3-nitrobenzene
InChI:
InChI=1S/C15H15NO4/c1-2-19-14-6-8-15(9-7-14)20-11-12-4-3-5-13(10-12)16(17)18/h3-10H,2,11H2,1H3
InChI Key:
DJYWZXDFSPMMTR-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)OCc1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.1g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.288g/mol
Monoisotopic Mass:
273.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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