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21570-31-0

21570-31-0 | 8-Quinolinethiol, 1,2,3,4-tetrahydro-

CAS No: 21570-31-0 Catalog No: AG007PX4 MDL No:

Product Description

Catalog Number:
AG007PX4
Chemical Name:
8-Quinolinethiol, 1,2,3,4-tetrahydro-
CAS Number:
21570-31-0
Molecular Formula:
C9H11NS
Molecular Weight:
165.2553
IUPAC Name:
1,2,3,4-tetrahydroquinoline-8-thiol
InChI:
InChI=1S/C9H11NS/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1,3,5,10-11H,2,4,6H2
InChI Key:
PBHWOBUIERAQKO-UHFFFAOYSA-N
SMILES:
Sc1cccc2c1NCCC2

Properties

Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.061g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.254g/mol
Monoisotopic Mass:
165.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
13A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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