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Home > Boronic Acids > 1704063-75-1
1704063-75-1 | (3-fluoro-5-(isopropoxyMethyl)phenyl)boronic acid
CAS No: 1704063-75-1 Catalog No: AG00ARB9 MDL No:MFCD23751359
Product Description
Catalog Number:
AG00ARB9
Chemical Name:
(3-fluoro-5-(isopropoxyMethyl)phenyl)boronic acid
CAS Number:
1704063-75-1
Molecular Formula:
C10H14BFO3
Molecular Weight:
212.0258
MDL Number:
MFCD23751359
IUPAC Name:
[3-fluoro-5-(propan-2-yloxymethyl)phenyl]boronic acid
InChI:
InChI=1S/C10H14BFO3/c1-7(2)15-6-8-3-9(11(13)14)5-10(12)4-8/h3-5,7,13-14H,6H2,1-2H3
InChI Key:
NESLBSAKMVCBNW-UHFFFAOYSA-N
SMILES:
CC(OCc1cc(F)cc(c1)B(O)O)C
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.102g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
212.027g/mol
Monoisotopic Mass:
212.102g/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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