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89647-37-0

89647-37-0 | 8-Quinolinethiol, 2-(methylthio)-

CAS No: 89647-37-0 Catalog No: AG003VVB MDL No:

Product Description

Catalog Number:
AG003VVB
Chemical Name:
8-Quinolinethiol, 2-(methylthio)-
CAS Number:
89647-37-0
Molecular Formula:
C10H9NS2
Molecular Weight:
207.3152
IUPAC Name:
2-methylsulfanylquinoline-8-thiol
InChI:
InChI=1S/C10H9NS2/c1-13-9-6-5-7-3-2-4-8(12)10(7)11-9/h2-6,12H,1H3
InChI Key:
OFEPPHSWRDVLOT-UHFFFAOYSA-N
SMILES:
CSc1ccc2c(n1)c(S)ccc2

Properties

Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.018g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.309g/mol
Monoisotopic Mass:
207.018g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

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