Home Halogens 2-chloro-5-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline

2-chloro-5-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline

CAS No.:
1244039-65-3
Catalog Number:
AG009Y2B
Molecular Formula:
C12H16BClFNO2
Molecular Weight:
271.5233
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Product Description
Catalog Number:
AG009Y2B
Chemical Name:
2-chloro-5-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
CAS Number:
1244039-65-3
Molecular Formula:
C12H16BClFNO2
Molecular Weight:
271.5233
MDL Number:
MFCD22207090
IUPAC Name:
2-chloro-5-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
InChI:
InChI=1S/C12H16BClFNO2/c1-11(2)12(3,4)18-13(17-11)8-5-7(15)6-9(16)10(8)14/h5-6H,16H2,1-4H3
InChI Key:
LXMXPKGROLGLJT-UHFFFAOYSA-N
SMILES:
Fc1cc(B2OC(C(O2)(C)C)(C)C)c(c(c1)N)Cl
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.095g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
271.523g/mol
Monoisotopic Mass:
271.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties