Home Boronic acids 1-Butylpyrazole-4-boronic acid

1-Butylpyrazole-4-boronic acid

CAS No.:
2096331-96-1
Catalog Number:
AG01EHGS
Molecular Formula:
C7H13BN2O2
Molecular Weight:
168.0013
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG01EHGS
Chemical Name:
1-Butylpyrazole-4-boronic acid
CAS Number:
2096331-96-1
Molecular Formula:
C7H13BN2O2
Molecular Weight:
168.0013
MDL Number:
MFCD20441847
IUPAC Name:
(1-butylpyrazol-4-yl)boronic acid
InChI:
InChI=1S/C7H13BN2O2/c1-2-3-4-10-6-7(5-9-10)8(11)12/h5-6,11-12H,2-4H2,1H3
InChI Key:
WJUJWRDQDMVDAH-UHFFFAOYSA-N
SMILES:
CCCCn1ncc(c1)B(O)O
Properties
Complexity:
135  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.107g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
168.003g/mol
Monoisotopic Mass:
168.107g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties