Thiocyanic acid, 2-amino-6-benzothiazolyl ester


Chemical Name: Thiocyanic acid, 2-amino-6-benzothiazolyl ester
CAS Number: 7170-77-6
Product Number: AG005FRG(AGN-PC-0JLTCV)
Synonyms:
MDL No:
Molecular Formula: C8H5N3S2
Molecular Weight: 207.2754

Identification/Properties


Properties
MP:
194-197 °C(lit.)
BP:
435.9 °C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
207.269g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
206.992g/mol
Monoisotopic Mass:
206.992g/mol
Topological Polar Surface Area:
116A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
237
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback