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Home > Aldehydes > 1160653-94-0
1160653-94-0 | Benzaldehyde, 3-bromo-2-fluoro-6-methoxy-
CAS No: 1160653-94-0 Catalog No: AG000BJ2 MDL No:MFCD15528066
Product Description
Catalog Number:
AG000BJ2
Chemical Name:
Benzaldehyde, 3-bromo-2-fluoro-6-methoxy-
CAS Number:
1160653-94-0
Molecular Formula:
C8H6BrFO2
Molecular Weight:
233.0344
MDL Number:
MFCD15528066
IUPAC Name:
3-bromo-2-fluoro-6-methoxybenzaldehyde
InChI:
InChI=1S/C8H6BrFO2/c1-12-7-3-2-6(9)8(10)5(7)4-11/h2-4H,1H3
InChI Key:
ZFSQBXCQHSTLJT-UHFFFAOYSA-N
SMILES:
O=Cc1c(OC)ccc(c1F)Br
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.954g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.036g/mol
Monoisotopic Mass:
231.954g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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