5-(chloromethyl)-3-(3-methylbutyl)-1,2,4-oxadiazole


Chemical Name: 5-(chloromethyl)-3-(3-methylbutyl)-1,2,4-oxadiazole
CAS Number: 1209200-59-8
Product Number: AG0093PR(AGN-PC-07HCPB)
Synonyms:
MDL No:
Molecular Formula: C8H13ClN2O
Molecular Weight: 188.6546

Identification/Properties


Computed Properties
Molecular Weight:
188.655g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
188.072g/mol
Monoisotopic Mass:
188.072g/mol
Topological Polar Surface Area:
38.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
132
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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