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Home > Boronic Acids > 160238-44-8
160238-44-8 | Boronic acid, (1,2-ethenediyldi-3,1-phenylene)bis-, (E)- (9CI)
CAS No: 160238-44-8 Catalog No: AG001RSE MDL No:
Product Description
Catalog Number:
AG001RSE
Chemical Name:
Boronic acid, (1,2-ethenediyldi-3,1-phenylene)bis-, (E)- (9CI)
CAS Number:
160238-44-8
Molecular Formula:
C14H14B2O4
Molecular Weight:
267.8806
IUPAC Name:
[3-[2-(3-boronophenyl)ethenyl]phenyl]boronic acid
InChI:
InChI=1S/C14H14B2O4/c17-15(18)13-5-1-3-11(9-13)7-8-12-4-2-6-14(10-12)16(19)20/h1-10,17-20H
InChI Key:
MVFRQCSRCULPII-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)/C=C/c1cccc(c1)B(O)O)O
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.108g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
267.882g/mol
Monoisotopic Mass:
268.108g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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