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

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

CAS No.:
1036273-29-6
Catalog Number:
AG01BHQG
Molecular Formula:
C9H8ClFO2
Molecular Weight:
202.6100
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Product Description
Catalog Number:
AG01BHQG
Chemical Name:
methyl 2-chloro-2-(4-fluorophenyl)acetate
CAS Number:
1036273-29-6
Molecular Formula:
C9H8ClFO2
Molecular Weight:
202.6100
MDL Number:
MFCD16694233
IUPAC Name:
methyl 2-chloro-2-(4-fluorophenyl)acetate
InChI:
InChI=1S/C9H8ClFO2/c1-13-9(12)8(10)6-2-4-7(11)5-3-6/h2-5,8H,1H3
InChI Key:
FTLXTMDPQAOBNK-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1ccc(cc1)F)Cl
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.02g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.609g/mol
Monoisotopic Mass:
202.02g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties