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


Chemical Name: 1,2,4-Oxadiazole, 5-(chloromethyl)-3-phenyl-
CAS Number: 1822-94-2
Product Number: AG0023H4(AGN-PC-0JYOGX)
Synonyms:
MDL No:
Molecular Formula: C9H7ClN2O
Molecular Weight: 194.6177

Identification/Properties


Computed Properties
Molecular Weight:
194.618g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
194.025g/mol
Monoisotopic Mass:
194.025g/mol
Topological Polar Surface Area:
38.9A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
162
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#:
1759
Hazard Statements:
H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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