Home Halogens methyl 2-chloro-2-(3-chloro-4-fluorophenyl)acetate

methyl 2-chloro-2-(3-chloro-4-fluorophenyl)acetate

CAS No.:
1368612-79-6
Catalog Number:
AG01DVY5
Molecular Formula:
C9H7Cl2FO2
Molecular Weight:
237.0551
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DVY5
Chemical Name:
methyl 2-chloro-2-(3-chloro-4-fluorophenyl)acetate
CAS Number:
1368612-79-6
Molecular Formula:
C9H7Cl2FO2
Molecular Weight:
237.0551
MDL Number:
MFCD21969100
IUPAC Name:
methyl 2-chloro-2-(3-chloro-4-fluorophenyl)acetate
InChI:
InChI=1S/C9H7Cl2FO2/c1-14-9(13)8(11)5-2-3-7(12)6(10)4-5/h2-4,8H,1H3
InChI Key:
VQSALKGMVWNVCK-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1ccc(c(c1)Cl)F)Cl
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.981g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.051g/mol
Monoisotopic Mass:
235.981g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties