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13944-94-0 | 2-[(2,2-DIETHOXYETHYL)THIO]-1,3-BENZOTHIAZOLE
CAS No: 13944-94-0 Catalog No: AG009BFH MDL No:
Product Description
Catalog Number:
AG009BFH
Chemical Name:
2-[(2,2-DIETHOXYETHYL)THIO]-1,3-BENZOTHIAZOLE
CAS Number:
13944-94-0
IUPAC Name:
2-(2,2-diethoxyethylsulfanyl)-1,3-benzothiazole
InChI:
InChI=1S/C13H17NO2S2/c1-3-15-12(16-4-2)9-17-13-14-10-7-5-6-8-11(10)18-13/h5-8,12H,3-4,9H2,1-2H3
InChI Key:
QQQBROKHBIJLTG-UHFFFAOYSA-N
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.07g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.404g/mol
Monoisotopic Mass:
283.07g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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