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163299-22-7 | 7-Benzothiazolol,2-ethyl-(9CI)
CAS No: 163299-22-7 Catalog No: AG00AVAR MDL No:
Product Description
Catalog Number:
AG00AVAR
Chemical Name:
7-Benzothiazolol,2-ethyl-(9CI)
CAS Number:
163299-22-7
IUPAC Name:
2-ethyl-1,3-benzothiazol-7-ol
InChI:
InChI=1S/C9H9NOS/c1-2-8-10-6-4-3-5-7(11)9(6)12-8/h3-5,11H,2H2,1H3
InChI Key:
NKIQLYRMTAIUSW-UHFFFAOYSA-N
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.04g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.237g/mol
Monoisotopic Mass:
179.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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