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Home > Aldehydes > 139277-46-6
139277-46-6 | Benzaldehyde, 2-iodo-6-(methoxymethoxy)-3-nitro-
CAS No: 139277-46-6 Catalog No: AG001AMT MDL No:
Product Description
Catalog Number:
AG001AMT
Chemical Name:
Benzaldehyde, 2-iodo-6-(methoxymethoxy)-3-nitro-
CAS Number:
139277-46-6
Molecular Formula:
C9H8INO5
Molecular Weight:
337.0680
IUPAC Name:
2-iodo-6-(methoxymethoxy)-3-nitrobenzaldehyde
InChI:
InChI=1S/C9H8INO5/c1-15-5-16-8-3-2-7(11(13)14)9(10)6(8)4-12/h2-4H,5H2,1H3
InChI Key:
NQWRAJMSDSGLTE-UHFFFAOYSA-N
SMILES:
COCOc1ccc(c(c1C=O)I)[N+](=O)[O-]
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.945g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.069g/mol
Monoisotopic Mass:
336.945g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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