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Home > Boronic Acids > 1256359-25-7
1256359-25-7 | 1H-Pyrazole, 1-(2,2-diethoxyethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1256359-25-7 Catalog No: AG000O78 MDL No:MFCD16295107
Product Description
Catalog Number:
AG000O78
Chemical Name:
1H-Pyrazole, 1-(2,2-diethoxyethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1256359-25-7
Molecular Formula:
C15H27BN2O4
Molecular Weight:
310.1969
MDL Number:
MFCD16295107
IUPAC Name:
1-(2,2-diethoxyethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
InChI:
InChI=1S/C15H27BN2O4/c1-7-19-13(20-8-2)11-18-10-12(9-17-18)16-21-14(3,4)15(5,6)22-16/h9-10,13H,7-8,11H2,1-6H3
InChI Key:
XOJUUYBIPJNLCT-UHFFFAOYSA-N
SMILES:
CCOC(Cn1ncc(c1)B1OC(C(O1)(C)C)(C)C)OCC
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.206g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.201g/mol
Monoisotopic Mass:
310.206g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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