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Home Boronic acids 3,5-Dimethyl-1-(THP)pyrazole-4-boronic acid

3,5-Dimethyl-1-(THP)pyrazole-4-boronic acid

CAS No.:
1217501-15-9
Catalog Number:
AG0015SN
Molecular Formula:
C10H17BN2O3
Molecular Weight:
224.0646
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$250
- +
5g
96%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG0015SN
Chemical Name:
3,5-Dimethyl-1-(THP)pyrazole-4-boronic acid
CAS Number:
1217501-15-9
Molecular Formula:
C10H17BN2O3
Molecular Weight:
224.0646
MDL Number:
MFCD12913940
IUPAC Name:
[3,5-dimethyl-1-(oxan-2-yl)pyrazol-4-yl]boronic acid
InChI:
InChI=1S/C10H17BN2O3/c1-7-10(11(14)15)8(2)13(12-7)9-5-3-4-6-16-9/h9,14-15H,3-6H2,1-2H3
InChI Key:
YOFFBMDCMBAWSH-UHFFFAOYSA-N
SMILES:
OB(c1c(C)nn(c1C)C1CCCCO1)O
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.133g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
224.067g/mol
Monoisotopic Mass:
224.133g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties