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Home > Nitro Compounds > 72567-42-1
72567-42-1 | 1-[2-(4-methylphenyl)ethoxy]-4-nitrobenzene
CAS No: 72567-42-1 Catalog No: AG00IT5E MDL No:MFCD05669090
Product Description
Catalog Number:
AG00IT5E
Chemical Name:
1-[2-(4-methylphenyl)ethoxy]-4-nitrobenzene
CAS Number:
72567-42-1
Molecular Formula:
C15H15NO3
Molecular Weight:
257.2845
MDL Number:
MFCD05669090
IUPAC Name:
1-methyl-4-[2-(4-nitrophenoxy)ethyl]benzene
InChI:
InChI=1S/C15H15NO3/c1-12-2-4-13(5-3-12)10-11-19-15-8-6-14(7-9-15)16(17)18/h2-9H,10-11H2,1H3
InChI Key:
MOXXGGNTJNSZCQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)CCOc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.105g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.289g/mol
Monoisotopic Mass:
257.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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