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Home > Nitro Compounds > 89563-24-6
89563-24-6 | Phenol, 2-ethoxy-4,6-dinitro-
CAS No: 89563-24-6 Catalog No: AG003Y7M MDL No:
Product Description
Catalog Number:
AG003Y7M
Chemical Name:
Phenol, 2-ethoxy-4,6-dinitro-
CAS Number:
89563-24-6
Molecular Formula:
C8H8N2O6
Molecular Weight:
228.1589
IUPAC Name:
2-ethoxy-4,6-dinitrophenol
InChI:
InChI=1S/C8H8N2O6/c1-2-16-7-4-5(9(12)13)3-6(8(7)11)10(14)15/h3-4,11H,2H2,1H3
InChI Key:
AOWXSXDTSFEHMV-UHFFFAOYSA-N
SMILES:
CCOc1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.038g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.16g/mol
Monoisotopic Mass:
228.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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