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1052686-60-8 | 2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine
CAS No: 1052686-60-8 Catalog No: AG008Z3A MDL No:MFCD13182190
Product Description
Catalog Number:
AG008Z3A
Chemical Name:
2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine
CAS Number:
1052686-60-8
Molecular Formula:
C11H17BN2O3
Molecular Weight:
236.0753
MDL Number:
MFCD13182190
IUPAC Name:
2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine
InChI:
InChI=1S/C11H17BN2O3/c1-10(2)11(3,4)17-12(16-10)8-6-13-9(15-5)14-7-8/h6-7H,1-5H3
InChI Key:
NPIOFBGJGBMTRC-UHFFFAOYSA-N
SMILES:
COc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.133g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.078g/mol
Monoisotopic Mass:
236.133g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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