Home Halogens 2-(chloromethyl)-5-[3-(trifluoromethyl)phenyl]-1,3-oxazole

2-(chloromethyl)-5-[3-(trifluoromethyl)phenyl]-1,3-oxazole

CAS No.:
70680-54-5
Catalog Number:
AG01ELVU
Molecular Formula:
C11H7ClF3NO
Molecular Weight:
261.6276
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Product Description
Catalog Number:
AG01ELVU
Chemical Name:
2-(chloromethyl)-5-[3-(trifluoromethyl)phenyl]-1,3-oxazole
CAS Number:
70680-54-5
Molecular Formula:
C11H7ClF3NO
Molecular Weight:
261.6276
MDL Number:
MFCD09835622
IUPAC Name:
2-(chloromethyl)-5-[3-(trifluoromethyl)phenyl]-1,3-oxazole
InChI:
InChI=1S/C11H7ClF3NO/c12-5-10-16-6-9(17-10)7-2-1-3-8(4-7)11(13,14)15/h1-4,6H,5H2
InChI Key:
NPWOKIXTYGLBDV-UHFFFAOYSA-N
SMILES:
ClCc1ncc(o1)c1cccc(c1)C(F)(F)F
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.017g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.628g/mol
Monoisotopic Mass:
261.017g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties