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681034-33-3 | 5-Benzothiazolol,2-propyl-(9CI)
CAS No: 681034-33-3 Catalog No: AG00FJR8 MDL No:
Product Description
Catalog Number:
AG00FJR8
Chemical Name:
5-Benzothiazolol,2-propyl-(9CI)
CAS Number:
681034-33-3
IUPAC Name:
2-propyl-1,3-benzothiazol-5-ol
InChI:
InChI=1S/C10H11NOS/c1-2-3-10-11-8-6-7(12)4-5-9(8)13-10/h4-6,12H,2-3H2,1H3
InChI Key:
UKRJSCUUNCTSEZ-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:
1
Isotope Atom Count:
0
Molecular Weight:
193.264g/mol
Monoisotopic Mass:
193.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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