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1247348-30-6 | 5-ETHYL-1,3-BENZOTHIAZOLE
CAS No: 1247348-30-6 Catalog No: AG009YY9 MDL No:
Product Description
Catalog Number:
AG009YY9
Chemical Name:
5-ETHYL-1,3-BENZOTHIAZOLE
CAS Number:
1247348-30-6
IUPAC Name:
5-ethyl-1,3-benzothiazole
InChI:
InChI=1S/C9H9NS/c1-2-7-3-4-9-8(5-7)10-6-11-9/h3-6H,2H2,1H3
InChI Key:
UMAALFHXVULYAZ-UHFFFAOYSA-N
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.046g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.238g/mol
Monoisotopic Mass:
163.046g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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