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53704-21-5

53704-21-5 | (2E)-2-[(2Z)-2-(3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE)ETHYLIDENE]-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE

CAS No: 53704-21-5 Catalog No: AG00DV69 MDL No:

Product Description

Catalog Number:
AG00DV69
Chemical Name:
(2E)-2-[(2Z)-2-(3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE)ETHYLIDENE]-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE
CAS Number:
53704-21-5
IUPAC Name:
2-[2-(3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]-3,4-dihydronaphthalen-1-one
InChI:
InChI=1S/C21H19NOS/c1-2-22-18-9-5-6-10-19(18)24-20(22)14-13-16-12-11-15-7-3-4-8-17(15)21(16)23/h3-10,13-14H,2,11-12H2,1H3
InChI Key:
YSUNOCYISGYCCX-UHFFFAOYSA-N

Properties

Complexity:
552  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.119g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.449g/mol
Monoisotopic Mass:
333.119g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2  
XLogP3:
5.3  

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