Benzothiazole, 2-chloro-6-methoxy-


Chemical Name: Benzothiazole, 2-chloro-6-methoxy-
CAS Number: 2605-14-3
Product Number: AG002RIR(AGN-PC-0JO449)
Synonyms:
MDL No:
Molecular Formula: C8H6ClNOS
Molecular Weight: 199.6573

Identification/Properties


Properties
MP:
54°C
BP:
293.5°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
199.652g/mol
XLogP3:
3.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
198.986g/mol
Monoisotopic Mass:
198.986g/mol
Topological Polar Surface Area:
50.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
169
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:
Warning
UN#:
N/A
Hazard Statements:
H302-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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