Home Halogens Methyl 4-amino-3,5-dibromo-2-fluorobenzoate

Methyl 4-amino-3,5-dibromo-2-fluorobenzoate

CAS No.:
2091146-39-1
Catalog Number:
AG01FB31
Molecular Formula:
C8H6Br2FNO2
Molecular Weight:
326.9451
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$267
- +
5g
95%
1 week
United States
$767
- +
25g
95%
1 week
United States
$2225
- +
Product Description
Catalog Number:
AG01FB31
Chemical Name:
Methyl 4-amino-3,5-dibromo-2-fluorobenzoate
CAS Number:
2091146-39-1
Molecular Formula:
C8H6Br2FNO2
Molecular Weight:
326.9451
MDL Number:
MFCD30834490
IUPAC Name:
methyl 4-amino-3,5-dibromo-2-fluorobenzoate
InChI:
InChI=1S/C8H6Br2FNO2/c1-14-8(13)3-2-4(9)7(12)5(10)6(3)11/h2H,12H2,1H3
InChI Key:
QMOUSJSHLCNMNI-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Br)c(c(c1F)Br)N
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.873g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
326.947g/mol
Monoisotopic Mass:
324.875g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties