Home Halogens 2-chloro-6-fluoro-4-methoxybenzoic acid

2-chloro-6-fluoro-4-methoxybenzoic acid

CAS No.:
1785280-62-7
Catalog Number:
AG01C5AS
Molecular Formula:
C8H6ClFO3
Molecular Weight:
204.5828
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Product Description
Catalog Number:
AG01C5AS
Chemical Name:
2-chloro-6-fluoro-4-methoxybenzoic acid
CAS Number:
1785280-62-7
Molecular Formula:
C8H6ClFO3
Molecular Weight:
204.5828
MDL Number:
MFCD28129775
IUPAC Name:
2-chloro-6-fluoro-4-methoxybenzoic acid
InChI:
InChI=1S/C8H6ClFO3/c1-13-4-2-5(9)7(8(11)12)6(10)3-4/h2-3H,1H3,(H,11,12)
InChI Key:
NLCFFGMUZGCKRN-UHFFFAOYSA-N
SMILES:
COc1cc(F)c(c(c1)Cl)C(=O)O
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.999g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.581g/mol
Monoisotopic Mass:
203.999g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties