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Structure

2-Butoxy-5-fluorophenylboronic acid

CAS
480438-62-8
Catalog Number
ACM480438628
Category
Other Products; Boronic Acids
Molecular Weight
212.03g/mol
Molecular Formula
C10H14BFO3

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Specification

IUPAC Name
(2-butoxy-5-fluorophenyl)boronic acid
Canonical SMILES
B(C1=C(C=CC(=C1)F)OCCCC)(O)O
InChI
InChI=1S/C10H14BFO3/c1-2-3-6-15-10-5-4-8(12)7-9(10)11(13)14/h4-5,7,13-14H,2-3,6H2,1H3
InChI Key
ILEICROJFBXMNF-UHFFFAOYSA-N
Complexity
180
Covalently-Bonded Unit Count
1
Exact Mass
212.102003g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
15
Monoisotopic Mass
212.102003g/mol
Rotatable Bond Count
5
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