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Home > Nitro Compounds > 86255-43-8
86255-43-8 | 1,3-dimethoxy-5-[(E)-2-nitroethenyl]benzene
CAS No: 86255-43-8 Catalog No: AG019ESR MDL No:MFCD00031526
Product Description
Catalog Number:
AG019ESR
Chemical Name:
1,3-dimethoxy-5-[(E)-2-nitroethenyl]benzene
CAS Number:
86255-43-8
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
MDL Number:
MFCD00031526
IUPAC Name:
1,3-dimethoxy-5-(2-nitroethenyl)benzene
InChI:
InChI=1S/C10H11NO4/c1-14-9-5-8(3-4-11(12)13)6-10(7-9)15-2/h3-7H,1-2H3
InChI Key:
LIROLLNTVLAPGP-UHFFFAOYSA-N
SMILES:
COc1cc(/C=C/[N+](=O)[O-])cc(c1)OC
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.201g/mol
Monoisotopic Mass:
209.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.1
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