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Home Halogens 1-Boc-3-bromo-6-fluoroindole

1-Boc-3-bromo-6-fluoroindole

CAS No.:
1314406-46-6
Catalog Number:
AG000W77
Molecular Formula:
C13H13BrFNO2
Molecular Weight:
314.1502
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$113
- +
5g
95%
In Stock USA
United States
$357
- +
Product Description
Catalog Number:
AG000W77
Chemical Name:
1-Boc-3-bromo-6-fluoroindole
CAS Number:
1314406-46-6
Molecular Formula:
C13H13BrFNO2
Molecular Weight:
314.1502
MDL Number:
MFCD19442769
IUPAC Name:
tert-butyl 3-bromo-6-fluoroindole-1-carboxylate
InChI:
InChI=1S/C13H13BrFNO2/c1-13(2,3)18-12(17)16-7-10(14)9-5-4-8(15)6-11(9)16/h4-7H,1-3H3
InChI Key:
MAERWTKKEZHNEC-UHFFFAOYSA-N
SMILES:
O=C(n1cc(c2c1cc(F)cc2)Br)OC(C)(C)C
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.011g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.154g/mol
Monoisotopic Mass:
313.011g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties