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Home > Boronic Acids > 849052-20-6
849052-20-6 | (2-Bromo-6-fluoro-3-propoxyphenyl)boronic acid
CAS No: 849052-20-6 Catalog No: AG003GQP MDL No:MFCD06411369
Product Description
Catalog Number:
AG003GQP
Chemical Name:
(2-Bromo-6-fluoro-3-propoxyphenyl)boronic acid
CAS Number:
849052-20-6
Molecular Formula:
C9H11BBrFO3
Molecular Weight:
276.8952
MDL Number:
MFCD06411369
IUPAC Name:
(2-bromo-6-fluoro-3-propoxyphenyl)boronic acid
InChI:
InChI=1S/C9H11BBrFO3/c1-2-5-15-7-4-3-6(12)8(9(7)11)10(13)14/h3-4,13-14H,2,5H2,1H3
InChI Key:
AIRJDYNENADRSB-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(c(c1Br)B(O)O)F
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.997g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
276.896g/mol
Monoisotopic Mass:
275.997g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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