1,2,4-Oxadiazole, 5-(chloromethyl)-3-[4-(methylthio)phenyl]-


Chemical Name: 1,2,4-Oxadiazole, 5-(chloromethyl)-3-[4-(methylthio)phenyl]-
CAS Number: 845887-08-3
Product Number: AG00529X(AGN-PC-051LYJ)
Synonyms:
MDL No:
Molecular Formula: C10H9ClN2OS
Molecular Weight: 240.7093

Identification/Properties


Computed Properties
Molecular Weight:
240.705g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
240.012g/mol
Monoisotopic Mass:
240.012g/mol
Topological Polar Surface Area:
64.2A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
200
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3261
Hazard Statements:
H302-H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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