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206860-47-1 | Benzene, 2-bromo-1-fluoro-3,5-dimethoxy-
CAS No: 206860-47-1 Catalog No: AG002IQG MDL No:MFCD00191848
Product Description
Catalog Number:
AG002IQG
Chemical Name:
Benzene, 2-bromo-1-fluoro-3,5-dimethoxy-
CAS Number:
206860-47-1
Molecular Formula:
C8H8BrFO2
Molecular Weight:
235.0503
MDL Number:
MFCD00191848
IUPAC Name:
2-bromo-1-fluoro-3,5-dimethoxybenzene
InChI:
InChI=1S/C8H8BrFO2/c1-11-5-3-6(10)8(9)7(4-5)12-2/h3-4H,1-2H3
InChI Key:
DGHHLXADLQCVKV-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c(c(c1)F)Br
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.969g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.052g/mol
Monoisotopic Mass:
233.969g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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