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80689-32-3 | Benzothiazole, 2-ethoxy-7-methyl- (9CI)
CAS No: 80689-32-3 Catalog No: AG00GCHK MDL No:
Product Description
Catalog Number:
AG00GCHK
Chemical Name:
Benzothiazole, 2-ethoxy-7-methyl- (9CI)
CAS Number:
80689-32-3
IUPAC Name:
2-ethoxy-7-methyl-1,3-benzothiazole
InChI:
InChI=1S/C10H11NOS/c1-3-12-10-11-8-6-4-5-7(2)9(8)13-10/h4-6H,3H2,1-2H3
InChI Key:
FJUFBFYPFLRCFG-UHFFFAOYSA-N
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.056g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.264g/mol
Monoisotopic Mass:
193.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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