4-FLUORO-2-PROPOXYPHENYLBORONIC ACID

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Catalog Number
ACM480438606
Product Name
4-FLUORO-2-PROPOXYPHENYLBORONIC ACID
Structure
Structure
CAS
480438-60-6
Category
Heterocyclic Organic Compound
IUPAC Name
(4-fluoro-2-propoxyphenyl)boronic acid
Molecular Weight
198g/mol
Molecular Formula
C9H12BFO3
Canonical SMILES
B(C1=C(C=C(C=C1)F)OCCC)(O)O
InChI
InChI=1S/C9H12BFO3/c1-2-5-14-9-6-7(11)3-4-8(9)10(12)13/h3-4,6,12-13H,2,5H2,1H3
InChI Key
RUOLRTURPYSKEY-UHFFFAOYSA-N
Complexity
168
Covalently-Bonded Unit Count
1
Exact Mass
198.086353g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
14
Monoisotopic Mass
198.086353g/mol
Rotatable Bond Count
4
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