Home Halogens 4-bromo-3-chloro-5-fluorobenzoic acid

4-bromo-3-chloro-5-fluorobenzoic acid

CAS No.:
1263274-74-3
Catalog Number:
AG01AF2P
Molecular Formula:
C7H3BrClFO2
Molecular Weight:
253.4529
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AF2P
Chemical Name:
4-bromo-3-chloro-5-fluorobenzoic acid
CAS Number:
1263274-74-3
Molecular Formula:
C7H3BrClFO2
Molecular Weight:
253.4529
MDL Number:
MFCD28954400
IUPAC Name:
4-bromo-3-chloro-5-fluorobenzoic acid
InChI:
InChI=1S/C7H3BrClFO2/c8-6-4(9)1-3(7(11)12)2-5(6)10/h1-2H,(H,11,12)
InChI Key:
FJCXNRXUXORNLD-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(F)c(c(c1)Cl)Br
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.899g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.451g/mol
Monoisotopic Mass:
251.899g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties