Home Halogens 5-(1-chloroethyl)-1,2,4-oxadiazole

5-(1-chloroethyl)-1,2,4-oxadiazole

CAS No.:
1249702-53-1
Catalog Number:
AG019S3A
Molecular Formula:
C4H5ClN2O
Molecular Weight:
132.5483
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Product Description
Catalog Number:
AG019S3A
Chemical Name:
5-(1-chloroethyl)-1,2,4-oxadiazole
CAS Number:
1249702-53-1
Molecular Formula:
C4H5ClN2O
Molecular Weight:
132.5483
MDL Number:
MFCD14605742
IUPAC Name:
5-(1-chloroethyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C4H5ClN2O/c1-3(5)4-6-2-7-8-4/h2-3H,1H3
InChI Key:
VSIPORBCZAHKKW-UHFFFAOYSA-N
SMILES:
CC(c1ncno1)Cl
Properties
Complexity:
80.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.009g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.547g/mol
Monoisotopic Mass:
132.009g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties