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Home > Boronic Acids > 900174-65-4
900174-65-4 | 3-Ethoxy-4-fluorobenzeneboronic acid
CAS No: 900174-65-4 Catalog No: AG00GTDR MDL No:MFCD09475831
Product Description
Catalog Number:
AG00GTDR
Chemical Name:
3-Ethoxy-4-fluorobenzeneboronic acid
CAS Number:
900174-65-4
Molecular Formula:
C8H10BFO3
Molecular Weight:
183.9726
MDL Number:
MFCD09475831
IUPAC Name:
(3-ethoxy-4-fluorophenyl)boronic acid
InChI:
InChI=1S/C8H10BFO3/c1-2-13-8-5-6(9(11)12)3-4-7(8)10/h3-5,11-12H,2H2,1H3
InChI Key:
IGAMLTGCYDPORS-UHFFFAOYSA-N
SMILES:
CCOc1cc(ccc1F)B(O)O
Properties
Complexity:
156
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:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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