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Home > Boronic Acids > 900175-54-4
900175-54-4 | (2-FLUORO-5-METHOXY-4-METHYLPHENYL)BORONIC ACID
CAS No: 900175-54-4 Catalog No: AG01EYYF MDL No:
Product Description
Catalog Number:
AG01EYYF
Chemical Name:
(2-FLUORO-5-METHOXY-4-METHYLPHENYL)BORONIC ACID
CAS Number:
900175-54-4
Molecular Formula:
C8H10BFO3
Molecular Weight:
183.9726
IUPAC Name:
(2-fluoro-5-methoxy-4-methylphenyl)boronic acid
InChI:
InChI=1S/C8H10BFO3/c1-5-3-7(10)6(9(11)12)4-8(5)13-2/h3-4,11-12H,1-2H3
InChI Key:
BCUJJSKVWGCGGM-UHFFFAOYSA-N
SMILES:
COc1cc(B(O)O)c(cc1C)F
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.071g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
183.973g/mol
Monoisotopic Mass:
184.071g/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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