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53761-60-7 | 4,8-DIMETHYLQUINOLINE-2-THIOL
CAS No: 53761-60-7 Catalog No: AG00DVD6 MDL No:MFCD06336109
Product Description
Catalog Number:
AG00DVD6
Chemical Name:
4,8-DIMETHYLQUINOLINE-2-THIOL
CAS Number:
53761-60-7
Molecular Formula:
C11H11NS
Molecular Weight:
189.2767
MDL Number:
MFCD06336109
IUPAC Name:
4,8-dimethyl-1H-quinoline-2-thione
InChI:
InChI=1S/C11H11NS/c1-7-4-3-5-9-8(2)6-10(13)12-11(7)9/h3-6H,1-2H3,(H,12,13)
InChI Key:
IDKGGDCCFSDICC-UHFFFAOYSA-N
SMILES:
Sc1cc(C)c2c(n1)c(C)ccc2
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.061g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.276g/mol
Monoisotopic Mass:
189.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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