Home Halogens 2-chloro-5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazole

2-chloro-5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazole

CAS No.:
1368427-75-1
Catalog Number:
AG01AM7N
Molecular Formula:
C9H6ClFN2O
Molecular Weight:
212.6081
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Product Description
Catalog Number:
AG01AM7N
Chemical Name:
2-chloro-5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazole
CAS Number:
1368427-75-1
Molecular Formula:
C9H6ClFN2O
Molecular Weight:
212.6081
MDL Number:
MFCD21884514
IUPAC Name:
2-chloro-5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazole
InChI:
InChI=1S/C9H6ClFN2O/c10-9-13-12-8(14-9)5-6-1-3-7(11)4-2-6/h1-4H,5H2
InChI Key:
XKZDZKVJUAGLJY-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)Cc1nnc(o1)Cl
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.015g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.608g/mol
Monoisotopic Mass:
212.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties