Home Halogens 2-(chloromethyl)-5-(oxan-3-yl)-1,3,4-oxadiazole

2-(chloromethyl)-5-(oxan-3-yl)-1,3,4-oxadiazole

CAS No.:
1343729-76-9
Catalog Number:
AG01C4EQ
Molecular Formula:
C8H11ClN2O2
Molecular Weight:
202.6381
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Product Description
Catalog Number:
AG01C4EQ
Chemical Name:
2-(chloromethyl)-5-(oxan-3-yl)-1,3,4-oxadiazole
CAS Number:
1343729-76-9
Molecular Formula:
C8H11ClN2O2
Molecular Weight:
202.6381
MDL Number:
MFCD17274816
IUPAC Name:
2-(chloromethyl)-5-(oxan-3-yl)-1,3,4-oxadiazole
InChI:
InChI=1S/C8H11ClN2O2/c9-4-7-10-11-8(13-7)6-2-1-3-12-5-6/h6H,1-5H2
InChI Key:
CQJJORWMPDNWBH-UHFFFAOYSA-N
SMILES:
ClCc1nnc(o1)C1CCCOC1
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.051g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.638g/mol
Monoisotopic Mass:
202.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
48.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties