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Home > Boronic Acids > 949146-39-8
949146-39-8 | 3-Fluoro-2,4-dimethoxyphenylboronic acid
CAS No: 949146-39-8 Catalog No: AG00IINF MDL No:MFCD23381042
Product Description
Catalog Number:
AG00IINF
Chemical Name:
3-Fluoro-2,4-dimethoxyphenylboronic acid
CAS Number:
949146-39-8
Molecular Formula:
C8H10BFO4
Molecular Weight:
199.9720
MDL Number:
MFCD23381042
IUPAC Name:
(3-fluoro-2,4-dimethoxyphenyl)boronic acid
InChI:
InChI=1S/C8H10BFO4/c1-13-6-4-3-5(9(11)12)8(14-2)7(6)10/h3-4,11-12H,1-2H3
InChI Key:
BISXERIORTWMKJ-UHFFFAOYSA-N
SMILES:
COc1c(F)c(OC)ccc1B(O)O
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.066g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.972g/mol
Monoisotopic Mass:
200.066g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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