Isoxazole, 5-(chloromethyl)-3-methyl-


Chemical Name: Isoxazole, 5-(chloromethyl)-3-methyl-
CAS Number: 40340-41-8
Product Number: AG00I7WT(AGN-PC-0LWTNK)
Synonyms:
MDL No:
Molecular Formula: C5H6ClNO
Molecular Weight: 131.5602

Identification/Properties


Computed Properties
Molecular Weight:
131.559g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
131.014g/mol
Monoisotopic Mass:
131.014g/mol
Topological Polar Surface Area:
26A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
78.8
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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