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63123-25-1 | 1-Ethyl-4,5-dihydronaphtho[1,2-d]thiazole-2(1H)-thione
CAS No: 63123-25-1 Catalog No: AG00ETYS MDL No:
Product Description
Catalog Number:
AG00ETYS
Chemical Name:
1-Ethyl-4,5-dihydronaphtho[1,2-d]thiazole-2(1H)-thione
CAS Number:
63123-25-1
IUPAC Name:
1-ethyl-4,5-dihydrobenzo[e][1,3]benzothiazole-2-thione
InChI:
InChI=1S/C13H13NS2/c1-2-14-12-10-6-4-3-5-9(10)7-8-11(12)16-13(14)15/h3-6H,2,7-8H2,1H3
InChI Key:
LLLDOZVMMUSWMD-UHFFFAOYSA-N
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.049g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.374g/mol
Monoisotopic Mass:
247.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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