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Home > Boronic Acids > 765917-27-9
765917-27-9 | 2-(4-Chloro-2-fluorophenyl);-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 765917-27-9 Catalog No: AG005JB4 MDL No:MFCD18729919
Product Description
Catalog Number:
AG005JB4
Chemical Name:
2-(4-Chloro-2-fluorophenyl);-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
765917-27-9
Molecular Formula:
C12H15BClFO2
Molecular Weight:
256.5087
MDL Number:
MFCD18729919
IUPAC Name:
2-(4-chloro-2-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C12H15BClFO2/c1-11(2)12(3,4)17-13(16-11)9-6-5-8(14)7-10(9)15/h5-7H,1-4H3
InChI Key:
HWHYSIMGKXYKDS-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.084g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.508g/mol
Monoisotopic Mass:
256.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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