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Home Boronic acids [2-(3,5-Dimethyl-1h-pyrazol-1-yl)-4-methoxyphenyl]boronic acid

[2-(3,5-Dimethyl-1h-pyrazol-1-yl)-4-methoxyphenyl]boronic acid

CAS No.:
1287753-37-0
Catalog Number:
AG00HRUS
Molecular Formula:
C12H15BN2O3
Molecular Weight:
246.0701
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
- +
5g
95%
In Stock USA
United States
$1136
- +
Product Description
Catalog Number:
AG00HRUS
Chemical Name:
[2-(3,5-Dimethyl-1h-pyrazol-1-yl)-4-methoxyphenyl]boronic acid
CAS Number:
1287753-37-0
Molecular Formula:
C12H15BN2O3
Molecular Weight:
246.0701
MDL Number:
MFCD08059991
IUPAC Name:
[2-(3,5-dimethylpyrazol-1-yl)-4-methoxyphenyl]boronic acid
InChI:
InChI=1S/C12H15BN2O3/c1-8-6-9(2)15(14-8)12-7-10(18-3)4-5-11(12)13(16)17/h4-7,16-17H,1-3H3
InChI Key:
SMUCSGQOJLQYHU-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)n1nc(cc1C)C)B(O)O
Properties
Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.118g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
246.073g/mol
Monoisotopic Mass:
246.118g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties