Home Carboxys 2-[2-(trifluoromethoxy)phenyl]cyclopropane-1-carboxylic acid

2-[2-(trifluoromethoxy)phenyl]cyclopropane-1-carboxylic acid

CAS No.:
1157562-08-7
Catalog Number:
AG01AKLA
Molecular Formula:
C11H9F3O3
Molecular Weight:
246.1826
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Product Description
Catalog Number:
AG01AKLA
Chemical Name:
2-[2-(trifluoromethoxy)phenyl]cyclopropane-1-carboxylic acid
CAS Number:
1157562-08-7
Molecular Formula:
C11H9F3O3
Molecular Weight:
246.1826
IUPAC Name:
2-[2-(trifluoromethoxy)phenyl]cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C11H9F3O3/c12-11(13,14)17-9-4-2-1-3-6(9)7-5-8(7)10(15)16/h1-4,7-8H,5H2,(H,15,16)
InChI Key:
URRRSJNYUQVDCI-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC1c1ccccc1OC(F)(F)F
Properties
Complexity:
303  
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:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties