Home Halogens 2-(3-chloropropyl)-5-(trifluoromethyl)-1,3,4-oxadiazole

2-(3-chloropropyl)-5-(trifluoromethyl)-1,3,4-oxadiazole

CAS No.:
1423034-48-3
Catalog Number:
AG01A1DL
Molecular Formula:
C6H6ClF3N2O
Molecular Weight:
214.5728
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Product Description
Catalog Number:
AG01A1DL
Chemical Name:
2-(3-chloropropyl)-5-(trifluoromethyl)-1,3,4-oxadiazole
CAS Number:
1423034-48-3
Molecular Formula:
C6H6ClF3N2O
Molecular Weight:
214.5728
MDL Number:
MFCD22421805
IUPAC Name:
2-(3-chloropropyl)-5-(trifluoromethyl)-1,3,4-oxadiazole
InChI:
InChI=1S/C6H6ClF3N2O/c7-3-1-2-4-11-12-5(13-4)6(8,9)10/h1-3H2
InChI Key:
KLCCNFZHWYCUNE-UHFFFAOYSA-N
SMILES:
ClCCCc1nnc(o1)C(F)(F)F
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.012g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.572g/mol
Monoisotopic Mass:
214.012g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties