4-(Bromomethyl)benzo[c][1,2,5]thiadiazole


Chemical Name: 4-(Bromomethyl)benzo[c][1,2,5]thiadiazole
CAS Number: 15936-06-8
Product Number: AG01BE3C(AGN-PC-0WAK2T)
Synonyms:
MDL No:
Molecular Formula: C6H5BrN2O2
Molecular Weight: 217.0201

Identification/Properties


Computed Properties
Molecular Weight:
217.022g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
215.953g/mol
Monoisotopic Mass:
215.953g/mol
Topological Polar Surface Area:
58.7A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
148
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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