Home Halogens 2-(dichloromethyl)-5-phenyl-1,3,4-oxadiazole

2-(dichloromethyl)-5-phenyl-1,3,4-oxadiazole

CAS No.:
95853-54-6
Catalog Number:
AG01AK5A
Molecular Formula:
C9H6Cl2N2O
Molecular Weight:
229.0627
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Product Description
Catalog Number:
AG01AK5A
Chemical Name:
2-(dichloromethyl)-5-phenyl-1,3,4-oxadiazole
CAS Number:
95853-54-6
Molecular Formula:
C9H6Cl2N2O
Molecular Weight:
229.0627
MDL Number:
MFCD13969266
IUPAC Name:
2-(dichloromethyl)-5-phenyl-1,3,4-oxadiazole
InChI:
InChI=1S/C9H6Cl2N2O/c10-7(11)9-13-12-8(14-9)6-4-2-1-3-5-6/h1-5,7H
InChI Key:
WUODGXHELFEINS-UHFFFAOYSA-N
SMILES:
ClC(c1nnc(o1)c1ccccc1)Cl
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.986g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.06g/mol
Monoisotopic Mass:
227.986g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties