Home Halogens 5-(chloromethyl)-1-[2-(2,2,2-trifluoroethoxy)ethyl]-1H-1,2,3,4-tetrazole

5-(chloromethyl)-1-[2-(2,2,2-trifluoroethoxy)ethyl]-1H-1,2,3,4-tetrazole

CAS No.:
1342882-56-7
Catalog Number:
AG01BDYQ
Molecular Formula:
C6H8ClF3N4O
Molecular Weight:
244.6021
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Product Description
Catalog Number:
AG01BDYQ
Chemical Name:
5-(chloromethyl)-1-[2-(2,2,2-trifluoroethoxy)ethyl]-1H-1,2,3,4-tetrazole
CAS Number:
1342882-56-7
Molecular Formula:
C6H8ClF3N4O
Molecular Weight:
244.6021
MDL Number:
MFCD18894665
IUPAC Name:
5-(chloromethyl)-1-[2-(2,2,2-trifluoroethoxy)ethyl]tetrazole
InChI:
InChI=1S/C6H8ClF3N4O/c7-3-5-11-12-13-14(5)1-2-15-4-6(8,9)10/h1-4H2
InChI Key:
SDMDSLAXDKVLGG-UHFFFAOYSA-N
SMILES:
ClCc1nnnn1CCOCC(F)(F)F
Properties
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.034g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.602g/mol
Monoisotopic Mass:
244.034g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties