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Home > Boronic Acids > 1072945-77-7
1072945-77-7 | 2-Chloro-6-fluoro-3-Methoxyphenylboronic acid
CAS No: 1072945-77-7 Catalog No: AG0090F5 MDL No:MFCD09972096
Product Description
Catalog Number:
AG0090F5
Chemical Name:
2-Chloro-6-fluoro-3-Methoxyphenylboronic acid
CAS Number:
1072945-77-7
Molecular Formula:
C7H7BClFO3
Molecular Weight:
204.3911
MDL Number:
MFCD09972096
IUPAC Name:
(2-chloro-6-fluoro-3-methoxyphenyl)boronic acid
InChI:
InChI=1S/C7H7BClFO3/c1-13-5-3-2-4(10)6(7(5)9)8(11)12/h2-3,11-12H,1H3
InChI Key:
DBGNLKDIFHCCCT-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1Cl)B(O)O)F
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.016g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
204.388g/mol
Monoisotopic Mass:
204.016g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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