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Home > Boronic Acids > 1032758-88-5
1032758-88-5 | tert-Butyl (5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-yl)carbamate
CAS No: 1032758-88-5 Catalog No: AG0085WP MDL No:MFCD09027069
Product Description
Catalog Number:
AG0085WP
Chemical Name:
tert-Butyl (5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-yl)carbamate
CAS Number:
1032758-88-5
Molecular Formula:
C15H24BN3O4
Molecular Weight:
321.1798
MDL Number:
MFCD09027069
IUPAC Name:
tert-butyl N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-yl]carbamate
InChI:
InChI=1S/C15H24BN3O4/c1-13(2,3)21-12(20)19-11-17-8-10(9-18-11)16-22-14(4,5)15(6,7)23-16/h8-9H,1-7H3,(H,17,18,19,20)
InChI Key:
XICHESWFGOSKMN-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
427
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.186g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
321.184g/mol
Monoisotopic Mass:
321.186g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
82.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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