Home Halogens methyl 6-chloro-3-fluoro-2-methylbenzoate

methyl 6-chloro-3-fluoro-2-methylbenzoate

CAS No.:
1376760-13-2
Catalog Number:
AG01DVYS
Molecular Formula:
C9H8ClFO2
Molecular Weight:
202.6100
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Product Description
Catalog Number:
AG01DVYS
Chemical Name:
methyl 6-chloro-3-fluoro-2-methylbenzoate
CAS Number:
1376760-13-2
Molecular Formula:
C9H8ClFO2
Molecular Weight:
202.6100
MDL Number:
MFCD28363904
IUPAC Name:
methyl 6-chloro-3-fluoro-2-methylbenzoate
InChI:
InChI=1S/C9H8ClFO2/c1-5-7(11)4-3-6(10)8(5)9(12)13-2/h3-4H,1-2H3
InChI Key:
XSIQLKKLCBHNJS-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(Cl)ccc(c1C)F
Properties
Complexity:
198  
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:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties