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Home > Boronic Acids > 864754-18-7

864754-18-7

864754-18-7 | 1-(2-Morpholinoethyl)-1H-pyrazole-4-boronic acid pinacol ester

CAS No: 864754-18-7 Catalog No: AG0038E8 MDL No:MFCD08062342

Product Description

Catalog Number:
AG0038E8
Chemical Name:
1-(2-Morpholinoethyl)-1H-pyrazole-4-boronic acid pinacol ester
CAS Number:
864754-18-7
Molecular Formula:
C15H26BN3O3
Molecular Weight:
307.1962
MDL Number:
MFCD08062342
IUPAC Name:
4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethyl]morpholine
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
SMILES:
CC1(C)OB(OC1(C)C)c1cnn(c1)CCN1CCOCC1

Properties

Complexity:
372  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.207g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.201g/mol
Monoisotopic Mass:
307.207g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
48.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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