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1418130-40-1 | 3-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
CAS No: 1418130-40-1 Catalog No: AG00IZHK MDL No:MFCD24039674
Product Description
Catalog Number:
AG00IZHK
Chemical Name:
3-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
CAS Number:
1418130-40-1
Molecular Formula:
C12H17BFNO2
Molecular Weight:
237.0783
MDL Number:
MFCD24039674
IUPAC Name:
3-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
InChI:
InChI=1S/C12H17BFNO2/c1-11(2)12(3,4)17-13(16-11)10-8(14)6-5-7-9(10)15/h5-7H,15H2,1-4H3
InChI Key:
LAKKWOYOTYQLEB-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1B1OC(C(O1)(C)C)(C)C)F
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.134g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.081g/mol
Monoisotopic Mass:
237.134g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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