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164414-62-4 | Benzofuran, 5-bromo-7-methoxy-
CAS No: 164414-62-4 Catalog No: AG001UVF MDL No:MFCD11877831
Product Description
Catalog Number:
AG001UVF
Chemical Name:
Benzofuran, 5-bromo-7-methoxy-
CAS Number:
164414-62-4
Molecular Formula:
C9H7BrO2
Molecular Weight:
227.0547
MDL Number:
MFCD11877831
IUPAC Name:
5-bromo-7-methoxy-1-benzofuran
InChI:
InChI=1S/C9H7BrO2/c1-11-8-5-7(10)4-6-2-3-12-9(6)8/h2-5H,1H3
InChI Key:
RFRKRHOQHQGVMZ-UHFFFAOYSA-N
SMILES:
COc1cc(Br)cc2c1occ2
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.963g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.057g/mol
Monoisotopic Mass:
225.963g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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