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Home > Boronic Acids > 1357387-81-5
1357387-81-5 | 2-Bromo-3-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
CAS No: 1357387-81-5 Catalog No: AG00A5I7 MDL No:MFCD17171339
Product Description
Catalog Number:
AG00A5I7
Chemical Name:
2-Bromo-3-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
CAS Number:
1357387-81-5
Molecular Formula:
C12H17BBrNO3
Molecular Weight:
313.9833
MDL Number:
MFCD17171339
IUPAC Name:
2-bromo-3-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C12H17BBrNO3/c1-11(2)12(3,4)18-13(17-11)8-6-7-15-10(14)9(8)16-5/h6-7H,1-5H3
InChI Key:
IGZDSVOBSNWDLY-UHFFFAOYSA-N
SMILES:
COc1c(Br)nccc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.048g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.986g/mol
Monoisotopic Mass:
313.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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