Home Boronic acids 1-(2-methoxyethyl)-1H-pyrazol-4-ylboronic acid

1-(2-methoxyethyl)-1H-pyrazol-4-ylboronic acid

CAS No.:
847818-59-1
Catalog Number:
AG00G8Z9
Molecular Formula:
C6H11BN2O3
Molecular Weight:
169.9741
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Product Description
Catalog Number:
AG00G8Z9
Chemical Name:
1-(2-methoxyethyl)-1H-pyrazol-4-ylboronic acid
CAS Number:
847818-59-1
Molecular Formula:
C6H11BN2O3
Molecular Weight:
169.9741
MDL Number:
MFCD12407377
IUPAC Name:
[1-(2-methoxyethyl)pyrazol-4-yl]boronic acid
InChI:
InChI=1S/C6H11BN2O3/c1-12-3-2-9-5-6(4-8-9)7(10)11/h4-5,10-11H,2-3H2,1H3
InChI Key:
JNFNGIRRDWRDBK-UHFFFAOYSA-N
SMILES:
COCCn1ncc(c1)B(O)O
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.086g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
169.975g/mol
Monoisotopic Mass:
170.086g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties