2H-1-Benzopyran-2-one, 3-(2-benzothiazolyl)-7-(diethylamino)-


Chemical Name: 2H-1-Benzopyran-2-one, 3-(2-benzothiazolyl)-7-(diethylamino)-
CAS Number: 38215-36-0
Product Number: AG00I7J0(AGN-PC-0JLC4O)
Synonyms:
MDL No:
Molecular Formula: C20H18N2O2S
Molecular Weight: 350.4341

Identification/Properties


Computed Properties
Molecular Weight:
350.436g/mol
XLogP3:
4.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
350.109g/mol
Monoisotopic Mass:
350.109g/mol
Topological Polar Surface Area:
70.7A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
534
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
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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