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Home > Boronic Acids > 2096329-94-9
2096329-94-9 | 3-Chloro-4-fluoro-5-(methoxycarbonyl)phenylboronic acid, pinacol ester
CAS No: 2096329-94-9 Catalog No: AG01EHN3 MDL No:MFCD18837625
Product Description
Catalog Number:
AG01EHN3
Chemical Name:
3-Chloro-4-fluoro-5-(methoxycarbonyl)phenylboronic acid, pinacol ester
CAS Number:
2096329-94-9
MDL Number:
MFCD18837625
IUPAC Name:
methyl 3-chloro-2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
InChI:
InChI=1S/C14H17BClFO4/c1-13(2)14(3,4)21-15(20-13)8-6-9(12(18)19-5)11(17)10(16)7-8/h6-7H,1-5H3
InChI Key:
BWDLQSGNBUZBJF-UHFFFAOYSA-N
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.089g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.544g/mol
Monoisotopic Mass:
314.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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