2-Benzothiazolamine, 6-chloro-4-(trifluoromethyl)-


Chemical Name: 2-Benzothiazolamine, 6-chloro-4-(trifluoromethyl)-
CAS Number: 155538-41-3
Product Number: AG001NYZ(AGN-PC-025K3J)
Synonyms:
MDL No:
Molecular Formula: C8H4ClF3N2S
Molecular Weight: 252.6440

Identification/Properties


Properties
MP:
158℃
Form:
Solid
Computed Properties
Molecular Weight:
252.639g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
0
Exact Mass:
251.974g/mol
Monoisotopic Mass:
251.974g/mol
Topological Polar Surface Area:
67.2A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
251
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#:
2811
Hazard Statements:
H301
Precautionary Statements:
P264-P270-P301+P310+P330-P405-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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