1-(2-Morpholinoethyl)-1H-pyrazole-4-boronic acid, pinacol ester

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Catalog Number
ACM864754187-1
Product Name
1-(2-Morpholinoethyl)-1H-pyrazole-4-boronic acid, pinacol ester
Structure
Structure
CAS
864754-18-7
Category
Boronic Esters
IUPAC Name
4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethyl]morpholine
Molecular Weight
307.2g/mol
Molecular Formula
C15H26BN3O3
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)CCN3CCOCC3
InChI
InChI=1S/C15H26BN3O3/c1-14(2)15(3,4)22-16(21-14)13-11-17-19(12-13)6-5-18-7-9-20-10-8-18/h11-12H,5-10H2,1-4H3
InChI Key
FBAPTUAEBQMVEY-UHFFFAOYSA-N
Complexity
372
Covalently-Bonded Unit Count
1
Exact Mass
307.206722g/mol
Formal Charge
0
H-Bond Acceptor
5
H-Bond Donor
0
Heavy Atom Count
22
Monoisotopic Mass
307.206722g/mol
Rotatable Bond Count
4
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