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Home > Aldehydes > 885952-37-4
885952-37-4 | 2-Bromo-5,6-dimethoxy-3-nitrobenzaldehyde
CAS No: 885952-37-4 Catalog No: AG01EY7R MDL No:
Product Description
Catalog Number:
AG01EY7R
Chemical Name:
2-Bromo-5,6-dimethoxy-3-nitrobenzaldehyde
CAS Number:
885952-37-4
Molecular Formula:
C9H8BrNO5
Molecular Weight:
290.0675
IUPAC Name:
2-bromo-5,6-dimethoxy-3-nitrobenzaldehyde
InChI:
InChI=1S/C9H8BrNO5/c1-15-7-3-6(11(13)14)8(10)5(4-12)9(7)16-2/h3-4H,1-2H3
InChI Key:
MURUZHYERMLROW-UHFFFAOYSA-N
SMILES:
COc1cc([N+](=O)[O-])c(c(c1OC)C=O)Br
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.959g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.069g/mol
Monoisotopic Mass:
288.959g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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