Home Other Building Blocks methyl 3-(2,2,2-trifluoroethoxy)benzoate

methyl 3-(2,2,2-trifluoroethoxy)benzoate

CAS No.:
35453-46-4
Catalog Number:
AG01AHI7
Molecular Formula:
C10H9F3O3
Molecular Weight:
234.1719
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Product Description
Catalog Number:
AG01AHI7
Chemical Name:
methyl 3-(2,2,2-trifluoroethoxy)benzoate
CAS Number:
35453-46-4
Molecular Formula:
C10H9F3O3
Molecular Weight:
234.1719
MDL Number:
MFCD18785474
IUPAC Name:
methyl 3-(2,2,2-trifluoroethoxy)benzoate
InChI:
InChI=1S/C10H9F3O3/c1-15-9(14)7-3-2-4-8(5-7)16-6-10(11,12)13/h2-5H,6H2,1H3
InChI Key:
JXHXPGXYHFEPBQ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1)OCC(F)(F)F
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.05g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.174g/mol
Monoisotopic Mass:
234.05g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties