Home Halogens Methyl 2-chloro-4-fluorobenzoate

Methyl 2-chloro-4-fluorobenzoate

CAS No.:
85953-29-3
Catalog Number:
AG003RNA
Molecular Formula:
C8H6ClFO2
Molecular Weight:
188.5834
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$14
- +
25g
98%
In Stock USA
United States
$50
- +
100g
98%
In Stock USA
United States
$125
- +
500g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG003RNA
Chemical Name:
Methyl 2-chloro-4-fluorobenzoate
CAS Number:
85953-29-3
Molecular Formula:
C8H6ClFO2
Molecular Weight:
188.5834
MDL Number:
MFCD00173937
IUPAC Name:
methyl 2-chloro-4-fluorobenzoate
InChI:
InChI=1S/C8H6ClFO2/c1-12-8(11)6-3-2-5(10)4-7(6)9/h2-4H,1H3
InChI Key:
YZDLPZNWBRBZMZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1Cl)F
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.004g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.582g/mol
Monoisotopic Mass:
188.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties