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Home > Boronic Acids > 250603-10-2
250603-10-2 | Boronic acid, B-[4-[(1E)-2-phenylethenyl]phenyl]-
CAS No: 250603-10-2 Catalog No: AG002QBD MDL No:
Product Description
Catalog Number:
AG002QBD
Chemical Name:
Boronic acid, B-[4-[(1E)-2-phenylethenyl]phenyl]-
CAS Number:
250603-10-2
Molecular Formula:
C14H13BO2
Molecular Weight:
224.0628
IUPAC Name:
[4-(2-phenylethenyl)phenyl]boronic acid
InChI:
InChI=1S/C14H13BO2/c16-15(17)14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h1-11,16-17H
InChI Key:
RAHFHNVYCKLZGU-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)/C=C/c1ccccc1)O
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.101g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
224.066g/mol
Monoisotopic Mass:
224.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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