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60786-69-8 | 2-(2-pyridylthio)benzothiazole
CAS No: 60786-69-8 Catalog No: AG00F4GG MDL No:
Product Description
Catalog Number:
AG00F4GG
Chemical Name:
2-(2-pyridylthio)benzothiazole
CAS Number:
60786-69-8
IUPAC Name:
2-pyridin-2-ylsulfanyl-1,3-benzothiazole
InChI:
InChI=1S/C12H8N2S2/c1-2-6-10-9(5-1)14-12(15-10)16-11-7-3-4-8-13-11/h1-8H
InChI Key:
BGAZQFOCUBDLQK-UHFFFAOYSA-N
EC Number:
262-431-2
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.013g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.33g/mol
Monoisotopic Mass:
244.013g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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