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Home > Boronic Acids > 930596-20-6
930596-20-6 | N,N-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-Pyrazole-1-acetamide
CAS No: 930596-20-6 Catalog No: AG00H5EU MDL No:MFCD18383279
Product Description
Catalog Number:
AG00H5EU
Chemical Name:
N,N-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-Pyrazole-1-acetamide
CAS Number:
930596-20-6
Molecular Formula:
C13H22BN3O3
Molecular Weight:
279.1431
MDL Number:
MFCD18383279
IUPAC Name:
N,N-dimethyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]acetamide
InChI:
InChI=1S/C13H22BN3O3/c1-12(2)13(3,4)20-14(19-12)10-7-15-17(8-10)9-11(18)16(5)6/h7-8H,9H2,1-6H3
InChI Key:
RVZZYZZVSAPLOO-UHFFFAOYSA-N
SMILES:
O=C(N(C)C)Cn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.175g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.147g/mol
Monoisotopic Mass:
279.175g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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