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Home > Aldehydes > 1805556-89-1
1805556-89-1 | Benzaldehyde, 3-bromo-5-fluoro-4-nitro-
CAS No: 1805556-89-1 Catalog No: AG00223J MDL No:
Product Description
Catalog Number:
AG00223J
Chemical Name:
Benzaldehyde, 3-bromo-5-fluoro-4-nitro-
CAS Number:
1805556-89-1
Molecular Formula:
C7H3BrFNO3
Molecular Weight:
248.0060
IUPAC Name:
3-bromo-5-fluoro-4-nitrobenzaldehyde
InChI:
InChI=1S/C7H3BrFNO3/c8-5-1-4(3-11)2-6(9)7(5)10(12)13/h1-3H
InChI Key:
WVACBERNMUBJAD-UHFFFAOYSA-N
SMILES:
O=Cc1cc(F)c(c(c1)Br)[N+](=O)[O-]
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.928g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.007g/mol
Monoisotopic Mass:
246.928g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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