Home Halogens 1,2,4-Oxadiazole, 3-methyl-5-(trichloromethyl)-

1,2,4-Oxadiazole, 3-methyl-5-(trichloromethyl)-

CAS No.:
1195-25-1
Catalog Number:
AG000IVS
Molecular Formula:
C4H3Cl3N2O
Molecular Weight:
201.4384
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Product Description
Catalog Number:
AG000IVS
Chemical Name:
1,2,4-Oxadiazole, 3-methyl-5-(trichloromethyl)-
CAS Number:
1195-25-1
Molecular Formula:
C4H3Cl3N2O
Molecular Weight:
201.4384
MDL Number:
MFCD01938299
IUPAC Name:
3-methyl-5-(trichloromethyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C4H3Cl3N2O/c1-2-8-3(10-9-2)4(5,6)7/h1H3
InChI Key:
ZHFWJCUKKDMFIV-UHFFFAOYSA-N
SMILES:
ClC(c1onc(n1)C)(Cl)Cl
UNII:
L7644EE165
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.931g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.431g/mol
Monoisotopic Mass:
199.931g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties