Home Carbonyls Methyl 3-[4-(ethoxycarbonyl)-3-fluorophenyl]-2-fluorobenzoate

Methyl 3-[4-(ethoxycarbonyl)-3-fluorophenyl]-2-fluorobenzoate

CAS No.:
1381944-56-4
Catalog Number:
AG00186P
Molecular Formula:
C17H14F2O4
Molecular Weight:
320.2875
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00186P
Chemical Name:
Methyl 3-[4-(ethoxycarbonyl)-3-fluorophenyl]-2-fluorobenzoate
CAS Number:
1381944-56-4
Molecular Formula:
C17H14F2O4
Molecular Weight:
320.2875
MDL Number:
MFCD22375054
IUPAC Name:
methyl 3-(4-ethoxycarbonyl-3-fluorophenyl)-2-fluorobenzoate
InChI:
InChI=1S/C17H14F2O4/c1-3-23-17(21)12-8-7-10(9-14(12)18)11-5-4-6-13(15(11)19)16(20)22-2/h4-9H,3H2,1-2H3
InChI Key:
AMBBTDZBXSSSBH-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(cc1F)c1cccc(c1F)C(=O)OC
Properties
Complexity:
429  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.086g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
320.292g/mol
Monoisotopic Mass:
320.086g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties