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Home > Boronic Acids > 849934-84-5
849934-84-5 | 2-ethoxy-5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoroMethyl)pyridine
CAS No: 849934-84-5 Catalog No: AG00GLW0 MDL No:MFCD12923429
Product Description
Catalog Number:
AG00GLW0
Chemical Name:
2-ethoxy-5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoroMethyl)pyridine
CAS Number:
849934-84-5
Molecular Formula:
C14H19BF3NO3
Molecular Weight:
317.1118
MDL Number:
MFCD12923429
IUPAC Name:
2-ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine
InChI:
InChI=1S/C14H19BF3NO3/c1-6-20-11-10(14(16,17)18)7-9(8-19-11)15-21-12(2,3)13(4,5)22-15/h7-8H,6H2,1-5H3
InChI Key:
VFZJQLKQCNJLIM-UHFFFAOYSA-N
SMILES:
CCOc1ncc(cc1C(F)(F)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.141g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.115g/mol
Monoisotopic Mass:
317.141g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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