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Structure

4-(4'-Propoxyphenyl)phenylboronic acid

CAS
849062-20-0
Catalog Number
ACM849062200
Category
Other Products
Molecular Weight
256.11g/mol
Molecular Formula
C15H17BO3

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Specification

IUPAC Name
[4-(4-propoxyphenyl)phenyl]boronic acid
Canonical SMILES
B(C1=CC=C(C=C1)C2=CC=C(C=C2)OCCC)(O)O
InChI
InChI=1S/C15H17BO3/c1-2-11-19-15-9-5-13(6-10-15)12-3-7-14(8-4-12)16(17)18/h3-10,17-18H,2,11H2,1H3
InChI Key
ZJCHLFOLMBDUPR-UHFFFAOYSA-N
Complexity
244
Covalently-Bonded Unit Count
1
Exact Mass
256.127075g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
2
Heavy Atom Count
19
Monoisotopic Mass
256.127075g/mol
Rotatable Bond Count
5
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