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Home > Boronic Acids > 1218791-37-7
1218791-37-7 | Acetamide, N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyrimidinyl]-
CAS No: 1218791-37-7 Catalog No: AG0016BL MDL No:MFCD12546523
Product Description
Catalog Number:
AG0016BL
Chemical Name:
Acetamide, N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyrimidinyl]-
CAS Number:
1218791-37-7
Molecular Formula:
C12H18BN3O3
Molecular Weight:
263.1006
MDL Number:
MFCD12546523
IUPAC Name:
N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-yl]acetamide
InChI:
InChI=1S/C12H18BN3O3/c1-8(17)16-10-14-6-9(7-15-10)13-18-11(2,3)12(4,5)19-13/h6-7H,1-5H3,(H,14,15,16,17)
InChI Key:
SDXPTCBMTXFYDK-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.144g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.104g/mol
Monoisotopic Mass:
263.144g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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