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Home Boronic acids 2-BOC-aminomethyl-5-fluorophenylboronic acid

2-BOC-aminomethyl-5-fluorophenylboronic acid

CAS No.:
850568-43-3
Catalog Number:
AG004PAI
Molecular Formula:
C12H17BFNO4
Molecular Weight:
269.0771
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$144
- +
5g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG004PAI
Chemical Name:
2-BOC-aminomethyl-5-fluorophenylboronic acid
CAS Number:
850568-43-3
Molecular Formula:
C12H17BFNO4
Molecular Weight:
269.0771
MDL Number:
MFCD04115639
IUPAC Name:
[5-fluoro-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]boronic acid
InChI:
InChI=1S/C12H17BFNO4/c1-12(2,3)19-11(16)15-7-8-4-5-9(14)6-10(8)13(17)18/h4-6,17-18H,7H2,1-3H3,(H,15,16)
InChI Key:
LQNCBYFATHDYFO-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCc1ccc(cc1B(O)O)F
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.123g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
269.079g/mol
Monoisotopic Mass:
269.123g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties