Home Halogens 1-(1-chloroethyl)-4-(trifluoromethoxy)benzene

1-(1-chloroethyl)-4-(trifluoromethoxy)benzene

CAS No.:
306296-69-5
Catalog Number:
AG019WNV
Molecular Formula:
C9H8ClF3O
Molecular Weight:
224.6074
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Product Description
Catalog Number:
AG019WNV
Chemical Name:
1-(1-chloroethyl)-4-(trifluoromethoxy)benzene
CAS Number:
306296-69-5
Molecular Formula:
C9H8ClF3O
Molecular Weight:
224.6074
MDL Number:
MFCD11186462
IUPAC Name:
1-(1-chloroethyl)-4-(trifluoromethoxy)benzene
InChI:
InChI=1S/C9H8ClF3O/c1-6(10)7-2-4-8(5-3-7)14-9(11,12)13/h2-6H,1H3
InChI Key:
FMKOVXXCOSGLCT-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)OC(F)(F)F)Cl
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.022g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.607g/mol
Monoisotopic Mass:
224.022g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties