Home Halogens 3-chlorocyclobutyl 2,2,2-trifluoroacetate, trans

3-chlorocyclobutyl 2,2,2-trifluoroacetate, trans

CAS No.:
1909286-49-2
Catalog Number:
AG01C2X8
Molecular Formula:
C6H6ClF3O2
Molecular Weight:
202.5588
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01C2X8
Chemical Name:
3-chlorocyclobutyl 2,2,2-trifluoroacetate, trans
CAS Number:
1909286-49-2
Molecular Formula:
C6H6ClF3O2
Molecular Weight:
202.5588
MDL Number:
MFCD29060319
IUPAC Name:
(3-chlorocyclobutyl) 2,2,2-trifluoroacetate
InChI:
InChI=1S/C6H6ClF3O2/c7-3-1-4(2-3)12-5(11)6(8,9)10/h3-4H,1-2H2
InChI Key:
KUIAJZPAYQAKRO-UHFFFAOYSA-N
SMILES:
Cl[C@@H]1C[C@H](C1)OC(=O)C(F)(F)F
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.001g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.557g/mol
Monoisotopic Mass:
202.001g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties