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Home Boronic acids 4-(E-3-Ethoxy-3-oxo-1-propen-1-yl)phenylboronic acid

4-(E-3-Ethoxy-3-oxo-1-propen-1-yl)phenylboronic acid

CAS No.:
850568-49-9
Catalog Number:
AG004PAH
Molecular Formula:
C11H13BO4
Molecular Weight:
220.0295
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$67
- +
5g
98%
In Stock USA
United States
$237
- +
25g
98%
In Stock USA
United States
$893
- +
Product Description
Catalog Number:
AG004PAH
Chemical Name:
4-(E-3-Ethoxy-3-oxo-1-propen-1-yl)phenylboronic acid
CAS Number:
850568-49-9
Molecular Formula:
C11H13BO4
Molecular Weight:
220.0295
MDL Number:
MFCD04115651
IUPAC Name:
[4-[(E)-3-ethoxy-3-oxoprop-1-enyl]phenyl]boronic acid
InChI:
InChI=1S/C11H13BO4/c1-2-16-11(13)8-5-9-3-6-10(7-4-9)12(14)15/h3-8,14-15H,2H2,1H3/b8-5+
InChI Key:
OVNZUEJWYIMMSW-VMPITWQZSA-N
SMILES:
CCOC(=O)/C=C/c1ccc(cc1)B(O)O
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
220.091g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
220.031g/mol
Monoisotopic Mass:
220.091g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties