Home Carboxys 1-[3-(trifluoromethoxy)phenyl]cyclopropane-1-carboxylic acid

1-[3-(trifluoromethoxy)phenyl]cyclopropane-1-carboxylic acid

CAS No.:
1260741-41-0
Catalog Number:
AG01C6IZ
Molecular Formula:
C11H9F3O3
Molecular Weight:
246.1826
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Product Description
Catalog Number:
AG01C6IZ
Chemical Name:
1-[3-(trifluoromethoxy)phenyl]cyclopropane-1-carboxylic acid
CAS Number:
1260741-41-0
Molecular Formula:
C11H9F3O3
Molecular Weight:
246.1826
MDL Number:
MFCD11037000
IUPAC Name:
1-[3-(trifluoromethoxy)phenyl]cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C11H9F3O3/c12-11(13,14)17-8-3-1-2-7(6-8)10(4-5-10)9(15)16/h1-3,6H,4-5H2,(H,15,16)
InChI Key:
KWULESULVXCFJM-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CC1)c1cccc(c1)OC(F)(F)F
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.05g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
246.185g/mol
Monoisotopic Mass:
246.05g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties