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Structure

4'-Propyl-3-fluoro-4-biphenyl boronic acid

CAS
909709-42-8
Catalog Number
ACM909709428
Category
Boronic Acids
Molecular Weight
258.1g/mol
Molecular Formula
C15H16BFO2

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Specification

Synonyms
3-Fluoro-4'-propylbiphenyl-4-boronic acid;4'-Propyl-3-fluorobiphenyl-4-boronic acid
IUPAC Name
[2-fluoro-4-(4-propylphenyl)phenyl]boronic acid
Canonical SMILES
B(C1=C(C=C(C=C1)C2=CC=C(C=C2)CCC)F)(O)O
InChI
InChI=1S/C15H16BFO2/c1-2-3-11-4-6-12(7-5-11)13-8-9-14(16(18)19)15(17)10-13/h4-10,18-19H,2-3H2,1H3
InChI Key
XZGCBSYWWZAXRC-UHFFFAOYSA-N
Complexity
267
Covalently-Bonded Unit Count
1
EC Number
618-687-6
Exact Mass
258.122738g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
2
Heavy Atom Count
19
Monoisotopic Mass
258.122738g/mol
Rotatable Bond Count
4
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