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Home Boronic acids [4-(Diethylcarbamoyl)-2-methoxy]phenylboronic acid

[4-(Diethylcarbamoyl)-2-methoxy]phenylboronic acid

CAS No.:
913835-34-4
Catalog Number:
AG006NKQ
Molecular Formula:
C12H18BNO4
Molecular Weight:
251.0866
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$150
- +
1g
98%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG006NKQ
Chemical Name:
[4-(Diethylcarbamoyl)-2-methoxy]phenylboronic acid
CAS Number:
913835-34-4
Molecular Formula:
C12H18BNO4
Molecular Weight:
251.0866
MDL Number:
MFCD09027199
IUPAC Name:
[4-(diethylcarbamoyl)-2-methoxyphenyl]boronic acid
InChI:
InChI=1S/C12H18BNO4/c1-4-14(5-2)12(15)9-6-7-10(13(16)17)11(8-9)18-3/h6-8,16-17H,4-5H2,1-3H3
InChI Key:
VKKSSTUUJZQAQY-UHFFFAOYSA-N
SMILES:
CCN(C(=O)c1ccc(c(c1)OC)B(O)O)CC
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.133g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
251.089g/mol
Monoisotopic Mass:
251.133g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties