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Home > Boronic Acids > 1093307-34-6
1093307-34-6 | 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl);-1H-pyrazole-1-propanamide
CAS No: 1093307-34-6 Catalog No: AG007B0Z MDL No:MFCD16660238
Product Description
Catalog Number:
AG007B0Z
Chemical Name:
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl);-1H-pyrazole-1-propanamide
CAS Number:
1093307-34-6
Molecular Formula:
C12H20BN3O3
Molecular Weight:
265.1165
MDL Number:
MFCD16660238
IUPAC Name:
3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propanamide
InChI:
InChI=1S/C12H20BN3O3/c1-11(2)12(3,4)19-13(18-11)9-7-15-16(8-9)6-5-10(14)17/h7-8H,5-6H2,1-4H3,(H2,14,17)
InChI Key:
POZMTDBIARATTJ-UHFFFAOYSA-N
SMILES:
NC(=O)CCn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.16g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.12g/mol
Monoisotopic Mass:
265.16g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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